N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide

C19H21N7O2 — CID 18455535

IUPACN-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2ncc3cc(N)c(=O)n(C4CCCC4)c3n2)nc1
InChIInChI=1S/C19H21N7O2/c1-11(27)23-13-6-7-16(21-10-13)24-19-22-9-12-8-15(20)18(28)26(17(12)25-19)14-4-2-3-5-14/h6-10,14H,2-5,20H2,1H3,(H,23,27)(H,21,22,24,25)
InChIKeyZBLXYWNWGKZONY-UHFFFAOYSA-N
MW379.42 g/mol
LogP2.59
Rot. Bonds4

About N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide

N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide (PubChem CID 18455535) has the molecular formula C19H21N7O2 and a molecular weight of 379.42 g/mol. Its IUPAC name is N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide
PubChem CID18455535
Molecular FormulaC19H21N7O2
Molecular Weight379.42 g/mol
Exact Mass379.18
IUPAC NameN-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2ncc3cc(N)c(=O)n(C4CCCC4)c3n2)nc1
InChIInChI=1S/C19H21N7O2/c1-11(27)23-13-6-7-16(21-10-13)24-19-22-9-12-8-15(20)18(28)26(17(12)25-19)14-4-2-3-5-14/h6-10,14H,2-5,20H2,1H3,(H,23,27)(H,21,22,24,25)
InChIKeyZBLXYWNWGKZONY-UHFFFAOYSA-N
XLogP2.59
TPSA127.82 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide with MolForge

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Related Compounds

N-[6-[[8-cyclopentyl-6-(hydroxymethyl)-7-oxopyrido[2,3-d]pyrimidin-2-yl]amino]-3-pyridinyl]acetamide
CID 22329966
6-amino-8-cyclopentyl-2-[(5-phenyl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one
CID 22329978
2-[(5-anilino-2-pyridinyl)amino]-6-bromo-8-cyclopentylpyrido[2,3-d]pyrimidin-7-one
CID 22330006
6-acetyl-8-cyclopentyl-2-[[5-(2-methoxyethylamino)-2-pyridinyl]amino]-5-methylpyrido[2,3-d]pyrimidin-7-one;6-amino-8-cyclopentyl-2-[(5-phenyl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one
CID 90280590
2-(4-acetamidoanilino)-7-cyclopentyl-N,N-dimethylpyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 178155437
6-acetyl-8-cyclopentyl-2-[[5-(2-methoxyethoxymethyl)-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7-one
CID 22329815
6-acetyl-2-[[5-(2-aminoethylamino)-2-pyridinyl]amino]-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one
CID 22329976
2-[[5-(azetidin-1-yl)-2-pyridinyl]amino]-8-cyclopentyl-6-ethylpyrido[2,3-d]pyrimidin-7-one
CID 22329937
6-bromo-8-cyclopentyl-2-[[5-[4-(diethylamino)butylamino]-2-pyridinyl]amino]pyrido[2,3-d]pyrimidin-7-one
CID 10239500
8-cyclopentyl-6-(hydroxymethyl)-2-[(5-pyrrolidin-1-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one
CID 22329821
ethyl 8-cyclopentyl-7-oxo-2-[(5-piperazin-1-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidine-6-carboxylate;hydrochloride
CID 10128284
8-cyclopentyl-2-[4-(3,5-dimethylpiperazin-1-yl)anilino]-6-(2-methylpropanoyl)pyrido[2,3-d]pyrimidin-7-one
CID 164813630

Frequently Asked Questions

What is the IUPAC name of N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide?
The IUPAC name of N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide (CID 18455535) is N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide.
What is the SMILES notation for N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide?
The canonical SMILES for N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide is CC(=O)Nc1ccc(Nc2ncc3cc(N)c(=O)n(C4CCCC4)c3n2)nc1.
What is the InChIKey of N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide?
The InChIKey is ZBLXYWNWGKZONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7O2/c1-11(27)23-13-6-7-16(21-10-13)24-19-22-9-12-8-15(20)18(28)26(17(12)25-19)14-4-2-3-5-14/h6-10,14H,2-5,20H2,1H3,(H,23,27)(H,21,22,24,25).
What are the key properties of N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide?
N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide has a molecular weight of 379.42 g/mol, XLogP of 2.59, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(6-amino-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridinyl]acetamide is sourced from PubChem (CID 18455535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).