2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide

C18H23N5O — CID 118375397

IUPAC2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide
SMILESCC(C)Nc1nc(N[C@@H]2CCc3ncccc3C2)ccc1C(N)=O
InChIInChI=1S/C18H23N5O/c1-11(2)21-18-14(17(19)24)6-8-16(23-18)22-13-5-7-15-12(10-13)4-3-9-20-15/h3-4,6,8-9,11,13H,5,7,10H2,1-2H3,(H2,19,24)(H2,21,22,23)/t13-/m1/s1
InChIKeyVGRLFLYVLRNBBM-CYBMUJFWSA-N
MW325.42 g/mol
LogP2.37
Rot. Bonds5

About 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide

2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide (PubChem CID 118375397) has the molecular formula C18H23N5O and a molecular weight of 325.42 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide
PubChem CID118375397
Molecular FormulaC18H23N5O
Molecular Weight325.42 g/mol
Exact Mass325.19
IUPAC Name2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide
SMILESCC(C)Nc1nc(N[C@@H]2CCc3ncccc3C2)ccc1C(N)=O
InChIInChI=1S/C18H23N5O/c1-11(2)21-18-14(17(19)24)6-8-16(23-18)22-13-5-7-15-12(10-13)4-3-9-20-15/h3-4,6,8-9,11,13H,5,7,10H2,1-2H3,(H2,19,24)(H2,21,22,23)/t13-/m1/s1
InChIKeyVGRLFLYVLRNBBM-CYBMUJFWSA-N
XLogP2.37
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide with MolForge

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Related Compounds

4-[(4-methylcyclohexyl)amino]-2-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyrimidine-5-carboxamide
CID 71242454
4-[[(1R,3S)-3-methylcycloheptyl]amino]-2-[[(6S)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyrimidine-5-carboxamide
CID 118375414
4-[[(1R,3S)-3-methylcycloheptyl]amino]-2-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyrimidine-5-carboxamide
CID 118375410
2-(propan-2-ylamino)-1,5-naphthyridine-3-carboxamide
CID 175753303
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridin-2-amine
CID 94392451
2-(cyclohexylamino)-4-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 71242271
2-[[(7S)-5,6,7,8-tetrahydroquinolin-7-yl]amino]pyrimidine-5-carboxamide
CID 156678006
6-methyl-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyridine-3-carbothioamide
CID 62304603
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 44761338
6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,3,6-triamine
CID 79825418
2-(3-aminobutylamino)pyridine-3-carboxamide
CID 63251486
3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-2-amine
CID 112568537

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide?
The IUPAC name of 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide (CID 118375397) is 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide?
The canonical SMILES for 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide is CC(C)Nc1nc(N[C@@H]2CCc3ncccc3C2)ccc1C(N)=O.
What is the InChIKey of 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide?
The InChIKey is VGRLFLYVLRNBBM-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H23N5O/c1-11(2)21-18-14(17(19)24)6-8-16(23-18)22-13-5-7-15-12(10-13)4-3-9-20-15/h3-4,6,8-9,11,13H,5,7,10H2,1-2H3,(H2,19,24)(H2,21,22,23)/t13-/m1/s1.
What are the key properties of 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide?
2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide has a molecular weight of 325.42 g/mol, XLogP of 2.37, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylamino)-6-[[(6R)-5,6,7,8-tetrahydroquinolin-6-yl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 118375397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).