N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide

C27H32N8O — CID 167366906

IUPACN-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(NC(=O)CCN4CCN(C(C)C)CC4)cc3n2)n1
InChIInChI=1S/C27H32N8O/c1-18(2)35-13-11-34(12-14-35)10-9-26(36)31-20-15-25-23(28-16-20)8-7-22(32-25)21-17-29-33-27(21)24-6-4-5-19(3)30-24/h4-8,15-18H,9-14H2,1-3H3,(H,29,33)(H,31,36)
InChIKeyUTGJJJJKSYTLJB-UHFFFAOYSA-N
MW484.61 g/mol
LogP3.74
Rot. Bonds7

About N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide

N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide (PubChem CID 167366906) has the molecular formula C27H32N8O and a molecular weight of 484.61 g/mol. Its IUPAC name is N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide
PubChem CID167366906
Molecular FormulaC27H32N8O
Molecular Weight484.61 g/mol
Exact Mass484.27
IUPAC NameN-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(NC(=O)CCN4CCN(C(C)C)CC4)cc3n2)n1
InChIInChI=1S/C27H32N8O/c1-18(2)35-13-11-34(12-14-35)10-9-26(36)31-20-15-25-23(28-16-20)8-7-22(32-25)21-17-29-33-27(21)24-6-4-5-19(3)30-24/h4-8,15-18H,9-14H2,1-3H3,(H,29,33)(H,31,36)
InChIKeyUTGJJJJKSYTLJB-UHFFFAOYSA-N
XLogP3.74
TPSA102.93 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.61
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-amine
CID 167366750
(2S)-2-[(4-methylphenyl)sulfonylamino]-N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-phenylpropanamide
CID 167366752
6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
CID 167366670
7-[3-(methoxymethyl)piperazin-1-yl]-2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
CID 167367071
2-[5-(3,4-difluorophenyl)-1H-pyrazol-4-yl]-7-(4-propan-2-ylpiperazin-1-yl)-1,5-naphthyridine
CID 146661723
N-(3-methylquinoxalin-6-yl)butanamide
CID 154505426
3-(4-benzhydrylpiperazin-1-yl)-N-(4,6-dimethyl-2-pyridinyl)propanamide
CID 10365291
2-[(3R,5S)-3,5-dimethylpiperazin-1-yl]ethyl 6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]quinoline-4-carboxylate
CID 167366460
ethane;N-(3-methylphenyl)-3-piperidin-1-ylpropanamide
CID 143383579
N-[9-methyl-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-ylpropanamide
CID 59868948
N-(6-amino-3-pyridinyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
CID 119516064
3-[4-[1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]piperazin-1-yl]-N-phenylpropanamide
CID 46406200

Frequently Asked Questions

What is the IUPAC name of N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide (CID 167366906) is N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide is Cc1cccc(-c2[nH]ncc2-c2ccc3ncc(NC(=O)CCN4CCN(C(C)C)CC4)cc3n2)n1.
What is the InChIKey of N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide?
The InChIKey is UTGJJJJKSYTLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N8O/c1-18(2)35-13-11-34(12-14-35)10-9-26(36)31-20-15-25-23(28-16-20)8-7-22(32-25)21-17-29-33-27(21)24-6-4-5-19(3)30-24/h4-8,15-18H,9-14H2,1-3H3,(H,29,33)(H,31,36).
What are the key properties of N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide?
N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide has a molecular weight of 484.61 g/mol, XLogP of 3.74, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-3-(4-propan-2-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 167366906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).