5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine

C14H16N4 — CID 64574343

IUPAC5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine
SMILESNCc1cnc(C2(c3ccccc3)CC2)nc1N
InChIInChI=1S/C14H16N4/c15-8-10-9-17-13(18-12(10)16)14(6-7-14)11-4-2-1-3-5-11/h1-5,9H,6-8,15H2,(H2,16,17,18)
InChIKeyPKWNGBHGTMWWHE-UHFFFAOYSA-N
MW240.31 g/mol
LogP1.60
Rot. Bonds3

About 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine

5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine (PubChem CID 64574343) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine
PubChem CID64574343
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine
SMILESNCc1cnc(C2(c3ccccc3)CC2)nc1N
InChIInChI=1S/C14H16N4/c15-8-10-9-17-13(18-12(10)16)14(6-7-14)11-4-2-1-3-5-11/h1-5,9H,6-8,15H2,(H2,16,17,18)
InChIKeyPKWNGBHGTMWWHE-UHFFFAOYSA-N
XLogP1.60
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-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

4-amino-2-(1-phenylcyclopentyl)pyrimidine-5-carboxylic acid
CID 116640865
6-(1-phenylcyclopropyl)-1,3,5-triazine-2,4-diamine
CID 112681528
4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine
CID 114207036
2-(1-phenylcyclopropyl)-4-propylpyrimidine-5-carboxylic acid
CID 63080465
2-[2-(1-phenylcyclopentyl)pyrimidin-5-yl]ethanamine
CID 63079037
[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 63079286
5-bromo-2-(1-phenylcyclopropyl)pyrimidine-4-carboxylic acid
CID 106512114
5-(aminomethyl)-2-(4-ethoxyoxan-4-yl)pyrimidin-4-amine
CID 116782235
6-methyl-2-(1-phenylcyclopropyl)-5-propan-2-ylpyrimidin-4-amine
CID 63078471
5-bromo-6-cyclopropyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine
CID 66304571
[5-(1-phenylcyclopropyl)-1,3-oxazol-2-yl]methanamine
CID 65180076
2-[6-oxo-2-(1-phenylcyclopropyl)-1H-pyrimidin-5-yl]acetic acid
CID 100591958

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The IUPAC name of 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine (CID 64574343) is 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine.
What is the SMILES notation for 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The canonical SMILES for 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine is NCc1cnc(C2(c3ccccc3)CC2)nc1N.
What is the InChIKey of 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The InChIKey is PKWNGBHGTMWWHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c15-8-10-9-17-13(18-12(10)16)14(6-7-14)11-4-2-1-3-5-11/h1-5,9H,6-8,15H2,(H2,16,17,18).
What are the key properties of 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine has a molecular weight of 240.31 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine is sourced from PubChem (CID 64574343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).