N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide

C23H30N6O — CID 172892560

IUPACN-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
SMILESCc1cc(C)c2ccc(N3CCC(CN(C)C(=O)c4cc(C)n(C)n4)CC3)nc2n1
InChIInChI=1S/C23H30N6O/c1-15-12-16(2)24-22-19(15)6-7-21(25-22)29-10-8-18(9-11-29)14-27(4)23(30)20-13-17(3)28(5)26-20/h6-7,12-13,18H,8-11,14H2,1-5H3
InChIKeyMBWNKIZAASWQFX-UHFFFAOYSA-N
MW406.53 g/mol
LogP3.28
Rot. Bonds4

About N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide

N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide (PubChem CID 172892560) has the molecular formula C23H30N6O and a molecular weight of 406.53 g/mol. Its IUPAC name is N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
PubChem CID172892560
Molecular FormulaC23H30N6O
Molecular Weight406.53 g/mol
Exact Mass406.25
IUPAC NameN-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
SMILESCc1cc(C)c2ccc(N3CCC(CN(C)C(=O)c4cc(C)n(C)n4)CC3)nc2n1
InChIInChI=1S/C23H30N6O/c1-15-12-16(2)24-22-19(15)6-7-21(25-22)29-10-8-18(9-11-29)14-27(4)23(30)20-13-17(3)28(5)26-20/h6-7,12-13,18H,8-11,14H2,1-5H3
InChIKeyMBWNKIZAASWQFX-UHFFFAOYSA-N
XLogP3.28
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,1,5-trimethyl-N-[[1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methyl]pyrazole-3-carboxamide
CID 172892523
N-[[1-(7-fluoroquinazolin-4-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
CID 172892514
N-[[1-(3-bromo-4-pyridinyl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
CID 172892168
N-[[1-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide
CID 172893358
N,1,5-trimethyl-N-[[1-(oxolan-3-ylmethyl)piperidin-4-yl]methyl]pyrazole-3-carboxamide
CID 172899868
N,1,5-trimethyl-N-[[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methyl]pyrazole-3-carboxamide
CID 172892283
N,1-dimethyl-N-[[1-(6-methyl-2-methylsulfanylpyrimidin-4-yl)piperidin-4-yl]methyl]imidazole-4-carboxamide
CID 172901096
N,1-dimethyl-N-[[1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]methyl]imidazole-4-carboxamide
CID 172881167
N,1,5-trimethyl-N-(1-pyrido[2,3-d]pyrimidin-4-ylpiperidin-4-yl)pyrazole-3-carboxamide
CID 172881810
6-[methyl-[(1-methylpiperidin-4-yl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 63235015
N-[[1-(6-chloroquinoxalin-2-yl)piperidin-4-yl]methyl]-N,1-dimethylimidazole-4-carboxamide
CID 172881971
N,1-dimethyl-N-[[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]methyl]imidazole-4-carboxamide
CID 172881133

Frequently Asked Questions

What is the IUPAC name of N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide?
The IUPAC name of N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide (CID 172892560) is N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide.
What is the SMILES notation for N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide?
The canonical SMILES for N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide is Cc1cc(C)c2ccc(N3CCC(CN(C)C(=O)c4cc(C)n(C)n4)CC3)nc2n1.
What is the InChIKey of N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide?
The InChIKey is MBWNKIZAASWQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N6O/c1-15-12-16(2)24-22-19(15)6-7-21(25-22)29-10-8-18(9-11-29)14-27(4)23(30)20-13-17(3)28(5)26-20/h6-7,12-13,18H,8-11,14H2,1-5H3.
What are the key properties of N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide?
N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide has a molecular weight of 406.53 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-4-yl]methyl]-N,1,5-trimethylpyrazole-3-carboxamide is sourced from PubChem (CID 172892560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).