6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine

C17H25N7 — CID 91788057

IUPAC6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESNC1CC(c2cc(NCCc3ccn[nH]3)nc(N3CCCC3)n2)C1
InChIInChI=1S/C17H25N7/c18-13-9-12(10-13)15-11-16(19-5-3-14-4-6-20-23-14)22-17(21-15)24-7-1-2-8-24/h4,6,11-13H,1-3,5,7-10,18H2,(H,20,23)(H,19,21,22)
InChIKeySGVJURFDFJQBSI-UHFFFAOYSA-N
MW327.44 g/mol
LogP1.66
Rot. Bonds6

About 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine

6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine (PubChem CID 91788057) has the molecular formula C17H25N7 and a molecular weight of 327.44 g/mol. Its IUPAC name is 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine
PubChem CID91788057
Molecular FormulaC17H25N7
Molecular Weight327.44 g/mol
Exact Mass327.22
IUPAC Name6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESNC1CC(c2cc(NCCc3ccn[nH]3)nc(N3CCCC3)n2)C1
InChIInChI=1S/C17H25N7/c18-13-9-12(10-13)15-11-16(19-5-3-14-4-6-20-23-14)22-17(21-15)24-7-1-2-8-24/h4,6,11-13H,1-3,5,7-10,18H2,(H,20,23)(H,19,21,22)
InChIKeySGVJURFDFJQBSI-UHFFFAOYSA-N
XLogP1.66
TPSA95.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.44
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-aminocyclobutyl)-N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-pyrrolidin-1-ylpyrimidin-4-amine;dihydrochloride
CID 154902279
6-(3-aminocyclobutyl)-N-[(5-methylpyrazin-2-yl)methyl]-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 91784124
6-(3-aminocyclobutyl)-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine;dihydrochloride
CID 154903345
2-[2-[[6-(3-aminocyclobutyl)-2-cyclopropylpyrimidin-4-yl]amino]ethyl]-4-methyl-1H-pyrimidin-6-one
CID 136664988
N-[2-(cyclohexen-1-yl)ethyl]-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112934210
6-(3-aminocyclobutyl)-2-cyclopropyl-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
CID 91782142
6-(3-aminocyclobutyl)-4-N-(3-pyridin-4-ylpropyl)pyrimidine-2,4-diamine
CID 91787226
6-(3-aminocyclobutyl)-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 91792566
6-(3-aminocyclobutyl)-4-N-[2-(4-methylphenyl)ethyl]pyrimidine-2,4-diamine;dihydrochloride
CID 154902401
6-(3-aminocyclobutyl)-4-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]pyrimidine-2,4-diamine
CID 91785904
6-(3-aminocyclobutyl)-N-[2-(1H-imidazol-5-yl)ethyl]-2-(methoxymethyl)pyrimidin-4-amine
CID 91786557
4-[2-[[6-(3-aminocyclobutyl)-2-methylpyrimidin-4-yl]amino]ethyl]benzenesulfonamide
CID 91793394

Frequently Asked Questions

What is the IUPAC name of 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine?
The IUPAC name of 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine (CID 91788057) is 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine?
The canonical SMILES for 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine is NC1CC(c2cc(NCCc3ccn[nH]3)nc(N3CCCC3)n2)C1.
What is the InChIKey of 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine?
The InChIKey is SGVJURFDFJQBSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N7/c18-13-9-12(10-13)15-11-16(19-5-3-14-4-6-20-23-14)22-17(21-15)24-7-1-2-8-24/h4,6,11-13H,1-3,5,7-10,18H2,(H,20,23)(H,19,21,22).
What are the key properties of 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine?
6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine has a molecular weight of 327.44 g/mol, XLogP of 1.66, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminocyclobutyl)-N-[2-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 91788057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).