5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine

C20H26N6 — CID 142456913

IUPAC5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESCCCc1cc2c(NC3CCCCC3)c(-c3ccnc(N)n3)cnc2[nH]1
InChIInChI=1S/C20H26N6/c1-2-6-14-11-15-18(24-13-7-4-3-5-8-13)16(12-23-19(15)25-14)17-9-10-22-20(21)26-17/h9-13H,2-8H2,1H3,(H2,21,22,26)(H2,23,24,25)
InChIKeyUZYCISYVTUBAOY-UHFFFAOYSA-N
MW350.47 g/mol
LogP4.30
Rot. Bonds5

About 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine

5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine (PubChem CID 142456913) has the molecular formula C20H26N6 and a molecular weight of 350.47 g/mol. Its IUPAC name is 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine.

Molecular Properties

Compound Name5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine
PubChem CID142456913
Molecular FormulaC20H26N6
Molecular Weight350.47 g/mol
Exact Mass350.22
IUPAC Name5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESCCCc1cc2c(NC3CCCCC3)c(-c3ccnc(N)n3)cnc2[nH]1
InChIInChI=1S/C20H26N6/c1-2-6-14-11-15-18(24-13-7-4-3-5-8-13)16(12-23-19(15)25-14)17-9-10-22-20(21)26-17/h9-13H,2-8H2,1H3,(H2,21,22,26)(H2,23,24,25)
InChIKeyUZYCISYVTUBAOY-UHFFFAOYSA-N
XLogP4.30
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 54.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine with MolForge

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Related Compounds

N-cyclohexyl-5-(6-methylpyridazin-3-yl)-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine
CID 142456930
4-(cyclohexylamino)-N-methyl-2-propyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 142456927
4-[(4-aminocyclohexyl)amino]-N-methyl-2-propyl-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 146434970
4-[[5-(2-aminopyrimidin-4-yl)-2-(butylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 118439924
4-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 91462753
N-cycloheptyl-4-[5-(4-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine
CID 129206403
6-[5-(2-aminopyrimidin-4-yl)-2-phenylmethoxyphenyl]-4-N-cyclohexylpyrimidine-2,4-diamine
CID 171853443
N-cyclohexyl-5-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine
CID 156781531
4-[1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-2-yl]pyrimidin-2-amine
CID 132776569
6-(cyclopentylamino)-2-propyl-1H-pyrimidine-4-thione
CID 82457343
4-N-cyclohexyl-6-N-propylpyrimidine-2,4,6-triamine
CID 80765080
4-chloro-2-(2-cyclohexylethyl)-1H-pyrrolo[2,3-b]pyridine
CID 170352114

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The IUPAC name of 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine (CID 142456913) is 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine.
What is the SMILES notation for 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The canonical SMILES for 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine is CCCc1cc2c(NC3CCCCC3)c(-c3ccnc(N)n3)cnc2[nH]1.
What is the InChIKey of 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
The InChIKey is UZYCISYVTUBAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6/c1-2-6-14-11-15-18(24-13-7-4-3-5-8-13)16(12-23-19(15)25-14)17-9-10-22-20(21)26-17/h9-13H,2-8H2,1H3,(H2,21,22,26)(H2,23,24,25).
What are the key properties of 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine?
5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine has a molecular weight of 350.47 g/mol, XLogP of 4.30, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopyrimidin-4-yl)-N-cyclohexyl-2-propyl-1H-pyrrolo[2,3-b]pyridin-4-amine is sourced from PubChem (CID 142456913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).