N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine

C23H32N6 — CID 142882675

IUPACN-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine
SMILESCCCC(CC)Nc1nccc(-c2c(C)nn3c(NC4CCCC4)cccc23)n1
InChIInChI=1S/C23H32N6/c1-4-9-17(5-2)26-23-24-15-14-19(27-23)22-16(3)28-29-20(22)12-8-13-21(29)25-18-10-6-7-11-18/h8,12-15,17-18,25H,4-7,9-11H2,1-3H3,(H,24,26,27)
InChIKeyRNKYDKDRUVGYTC-UHFFFAOYSA-N
MW392.55 g/mol
LogP5.44
Rot. Bonds8

About N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine

N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine (PubChem CID 142882675) has the molecular formula C23H32N6 and a molecular weight of 392.55 g/mol. Its IUPAC name is N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine.

Molecular Properties

Compound NameN-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine
PubChem CID142882675
Molecular FormulaC23H32N6
Molecular Weight392.55 g/mol
Exact Mass392.27
IUPAC NameN-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine
SMILESCCCC(CC)Nc1nccc(-c2c(C)nn3c(NC4CCCC4)cccc23)n1
InChIInChI=1S/C23H32N6/c1-4-9-17(5-2)26-23-24-15-14-19(27-23)22-16(3)28-29-20(22)12-8-13-21(29)25-18-10-6-7-11-18/h8,12-15,17-18,25H,4-7,9-11H2,1-3H3,(H,24,26,27)
InChIKeyRNKYDKDRUVGYTC-UHFFFAOYSA-N
XLogP5.44
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.55
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine with MolForge

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Related Compounds

N-cyclopentyl-2-[2-(cyclopentylamino)-4-pyridinyl]-3-[2-(propan-2-ylamino)pyrimidin-4-yl]pyrazolo[1,5-a]pyridin-7-amine
CID 10289087
2-(3-chlorophenyl)-N-cyclopentyl-3-[2-(cyclopentylamino)pyrimidin-4-yl]pyrazolo[1,5-a]pyridin-7-amine
CID 10205592
N-cyclopentyl-3-[2-(cyclopentylamino)pyrimidin-4-yl]-2-(3-methoxyphenyl)pyrazolo[1,5-a]pyridin-7-amine
CID 10298784
N-cyclobutyl-4-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-2-amine
CID 46985481
5-chloro-3-[2-(cyclopentylamino)pyrimidin-4-yl]-N-cyclopropyl-2-(3-methylphenyl)pyrazolo[1,5-a]pyridin-7-amine
CID 10115398
4-[7-chloro-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopentylpyrimidin-2-amine
CID 57444748
2-[4-[[3-[2-(cyclopentylamino)pyrimidin-4-yl]-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-7-yl]amino]butyl]guanidine
CID 10229481
N-cyclohexyl-4-[2-(7-methyloctan-4-yl)-4-(3-methylphenyl)-2,3-dihydro-1,3-thiazol-5-yl]pyrimidin-2-amine
CID 143376448
4-[2-(cyclopentylamino)pyrimidin-4-yl]-N-cyclopropyl-2-(3-fluorophenyl)pyrazolo[1,5-a]pyridin-7-amine
CID 58775616
N-cyclohexyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 143769216
1-[4-[[3-[2-(cyclopentylamino)pyrimidin-4-yl]-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-7-yl]amino]butyl]-3-(4-methylphenyl)sulfonylurea
CID 10305206
2-N-butan-2-yl-4-N-cycloheptylpyrimidine-2,4-diamine
CID 112883736

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine?
The IUPAC name of N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine (CID 142882675) is N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine.
What is the SMILES notation for N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine?
The canonical SMILES for N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine is CCCC(CC)Nc1nccc(-c2c(C)nn3c(NC4CCCC4)cccc23)n1.
What is the InChIKey of N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine?
The InChIKey is RNKYDKDRUVGYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N6/c1-4-9-17(5-2)26-23-24-15-14-19(27-23)22-16(3)28-29-20(22)12-8-13-21(29)25-18-10-6-7-11-18/h8,12-15,17-18,25H,4-7,9-11H2,1-3H3,(H,24,26,27).
What are the key properties of N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine?
N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine has a molecular weight of 392.55 g/mol, XLogP of 5.44, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[2-(hexan-3-ylamino)pyrimidin-4-yl]-2-methylpyrazolo[1,5-a]pyridin-7-amine is sourced from PubChem (CID 142882675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).