6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide

C24H31N5O2 — CID 135154037

IUPAC6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide
SMILESCc1cc(C(=O)NC2CCc3ncccc3C2)nnc1N1CCC(OCC2CC2)CC1
InChIInChI=1S/C24H31N5O2/c1-16-13-22(24(30)26-19-6-7-21-18(14-19)3-2-10-25-21)27-28-23(16)29-11-8-20(9-12-29)31-15-17-4-5-17/h2-3,10,13,17,19-20H,4-9,11-12,14-15H2,1H3,(H,26,30)
InChIKeyHCAHTLXZXMTBCR-UHFFFAOYSA-N
MW421.55 g/mol
LogP2.86
Rot. Bonds6

About 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide

6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide (PubChem CID 135154037) has the molecular formula C24H31N5O2 and a molecular weight of 421.55 g/mol. Its IUPAC name is 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide
PubChem CID135154037
Molecular FormulaC24H31N5O2
Molecular Weight421.55 g/mol
Exact Mass421.25
IUPAC Name6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide
SMILESCc1cc(C(=O)NC2CCc3ncccc3C2)nnc1N1CCC(OCC2CC2)CC1
InChIInChI=1S/C24H31N5O2/c1-16-13-22(24(30)26-19-6-7-21-18(14-19)3-2-10-25-21)27-28-23(16)29-11-8-20(9-12-29)31-15-17-4-5-17/h2-3,10,13,17,19-20H,4-9,11-12,14-15H2,1H3,(H,26,30)
InChIKeyHCAHTLXZXMTBCR-UHFFFAOYSA-N
XLogP2.86
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.55
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide with MolForge

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Related Compounds

6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-5-methyl-N-[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]pyridazine-3-carboxamide
CID 139581410
6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-5-methyl-N-[(7S)-5,6,7,8-tetrahydroquinolin-7-yl]pyridazine-3-carboxamide
CID 135153980
6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-5-methyl-N-[(7S)-5,6,7,8-tetrahydroisoquinolin-7-yl]pyridazine-3-carboxamide;6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-5-methyl-N-[(7R)-5,6,7,8-tetrahydroisoquinolin-7-yl]pyridazine-3-carboxamide
CID 159223114
6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-N-[(2S)-6-[[3-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-6-(1,2,3,4-tetrahydronaphthalen-2-ylcarbamoyl)pyridazin-4-yl]methyl]-1,2,3,4-tetrahydronaphthalen-2-yl]-5-methylpyridazine-3-carboxamide
CID 135171066
N-(3-bicyclo[3.1.1]heptanyl)-5-methyl-6-[4-[(2-methyl-3-oxo-1H-isoindol-5-yl)oxy]piperidin-1-yl]pyridazine-3-carboxamide
CID 135175096
2-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 10199216
4-ethoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-1-carboxamide
CID 154780747
5-ethyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazole-3-carboxamide
CID 146109258
4-[(4-methylcyclohexyl)amino]-2-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyrimidine-5-carboxamide
CID 71242454
N-[[1-(3-cyano-2-pyridinyl)piperidin-4-yl]methyl]-3,4-dimethylbenzamide
CID 121108885
N-[(3R)-1-methylpyrrolidin-3-yl]pyridine-2-carboxamide
CID 59568965
6-[4-[(6-methoxy-3-pyridinyl)oxy]piperidin-1-yl]-5-methyl-N-(1-methylcyclopentyl)pyridazine-3-carboxamide
CID 135154077

Frequently Asked Questions

What is the IUPAC name of 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide (CID 135154037) is 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide is Cc1cc(C(=O)NC2CCc3ncccc3C2)nnc1N1CCC(OCC2CC2)CC1.
What is the InChIKey of 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide?
The InChIKey is HCAHTLXZXMTBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N5O2/c1-16-13-22(24(30)26-19-6-7-21-18(14-19)3-2-10-25-21)27-28-23(16)29-11-8-20(9-12-29)31-15-17-4-5-17/h2-3,10,13,17,19-20H,4-9,11-12,14-15H2,1H3,(H,26,30).
What are the key properties of 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide?
6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide has a molecular weight of 421.55 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(cyclopropylmethoxy)piperidin-1-yl]-5-methyl-N-(5,6,7,8-tetrahydroquinolin-6-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 135154037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).