6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide

C22H30N4O2 — CID 144575495

IUPAC6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide
SMILESCc1ccc2nc(N3CCC(NC4(C)CCOCC4)CC3)c(C(N)=O)cc2c1
InChIInChI=1S/C22H30N4O2/c1-15-3-4-19-16(13-15)14-18(20(23)27)21(24-19)26-9-5-17(6-10-26)25-22(2)7-11-28-12-8-22/h3-4,13-14,17,25H,5-12H2,1-2H3,(H2,23,27)
InChIKeyDMZABZCJBRSCSL-UHFFFAOYSA-N
MW382.51 g/mol
LogP2.77
Rot. Bonds4

About 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide

6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide (PubChem CID 144575495) has the molecular formula C22H30N4O2 and a molecular weight of 382.51 g/mol. Its IUPAC name is 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide
PubChem CID144575495
Molecular FormulaC22H30N4O2
Molecular Weight382.51 g/mol
Exact Mass382.24
IUPAC Name6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide
SMILESCc1ccc2nc(N3CCC(NC4(C)CCOCC4)CC3)c(C(N)=O)cc2c1
InChIInChI=1S/C22H30N4O2/c1-15-3-4-19-16(13-15)14-18(20(23)27)21(24-19)26-9-5-17(6-10-26)25-22(2)7-11-28-12-8-22/h3-4,13-14,17,25H,5-12H2,1-2H3,(H2,23,27)
InChIKeyDMZABZCJBRSCSL-UHFFFAOYSA-N
XLogP2.77
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide with MolForge

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Related Compounds

azane;2-[4-(cyclohexylmethylamino)piperidin-1-yl]-6-methylquinoline-3-carboxamide;ethene;molecular hydrogen
CID 144575824
N-(1-aminoethyl)-6-methyl-2-[4-(oxolan-3-ylamino)piperidin-1-yl]quinoline-3-carboxamide
CID 123963874
N-[amino-[2-[4-(cyclopentylamino)piperidin-1-yl]-6-methylquinolin-3-yl]methylidene]acetamide
CID 118263989
cyclopropylmethanimine;6-methyl-2-[4-(2-methylpropylamino)piperidin-1-yl]quinoline-3-carboxamide;molecular hydrogen
CID 144576041
N-(1-aminoethylidene)-2-[4-[[(1S,2S)-2-hydroxycyclopentyl]amino]piperidin-1-yl]-6-methylquinoline-3-carboxamide
CID 118264143
N-cyclohexyl-4-methyl-1-[6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-amine
CID 118263814
(E)-3-(6-methyl-2-morpholin-4-ylquinolin-3-yl)prop-2-enamide
CID 170877903
N-(1-aminoethyl)-2-[3-methoxy-4-(oxan-4-ylamino)piperidin-1-yl]-6-methylquinoline-3-carboxamide
CID 123907760
[N-[amino(cyclopropyl)methyl]-C-[6-methyl-2-[4-(2-methylpropylamino)piperidin-1-yl]quinolin-3-yl]carbonimidoyl]oxidanium
CID 149467803
[(Z)-N-[amino(cyclopropyl)methyl]-C-[6-methyl-2-[4-(2-methylpropylamino)piperidin-1-yl]quinolin-3-yl]carbonimidoyl]oxidanium
CID 144575717
6-fluoro-N'-(1-hydroxyethyl)-2-[4-(oxan-4-ylamino)piperidin-1-yl]quinoline-3-carboximidamide
CID 139324479
N-cyclopentyl-1-[3-(4-iminopent-2-enimidoyl)-6-methylquinolin-2-yl]piperidin-4-amine
CID 123307719

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide?
The IUPAC name of 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide (CID 144575495) is 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide.
What is the SMILES notation for 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide?
The canonical SMILES for 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide is Cc1ccc2nc(N3CCC(NC4(C)CCOCC4)CC3)c(C(N)=O)cc2c1.
What is the InChIKey of 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide?
The InChIKey is DMZABZCJBRSCSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O2/c1-15-3-4-19-16(13-15)14-18(20(23)27)21(24-19)26-9-5-17(6-10-26)25-22(2)7-11-28-12-8-22/h3-4,13-14,17,25H,5-12H2,1-2H3,(H2,23,27).
What are the key properties of 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide?
6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide has a molecular weight of 382.51 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[4-[(4-methyloxan-4-yl)amino]piperidin-1-yl]quinoline-3-carboxamide is sourced from PubChem (CID 144575495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).