5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine

C13H19ClN4 — CID 106640995

IUPAC5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
SMILESClc1cnc(N(CC2CCCCN2)C2CC2)nc1
InChIInChI=1S/C13H19ClN4/c14-10-7-16-13(17-8-10)18(12-4-5-12)9-11-3-1-2-6-15-11/h7-8,11-12,15H,1-6,9H2
InChIKeyASHQNRAMKAKMHD-UHFFFAOYSA-N
MW266.78 g/mol
LogP2.24
Rot. Bonds4

About 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine

5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine (PubChem CID 106640995) has the molecular formula C13H19ClN4 and a molecular weight of 266.78 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
PubChem CID106640995
Molecular FormulaC13H19ClN4
Molecular Weight266.78 g/mol
Exact Mass266.13
IUPAC Name5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
SMILESClc1cnc(N(CC2CCCCN2)C2CC2)nc1
InChIInChI=1S/C13H19ClN4/c14-10-7-16-13(17-8-10)18(12-4-5-12)9-11-3-1-2-6-15-11/h7-8,11-12,15H,1-6,9H2
InChIKeyASHQNRAMKAKMHD-UHFFFAOYSA-N
XLogP2.24
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.78
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-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

5-chloro-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-2-amine
CID 106642347
5-bromo-N-cyclopropyl-4-methoxy-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 106998335
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyridine-2-carboxamide
CID 106626904
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 106641188
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-benzotriazin-3-amine
CID 106641209
N-cyclopropyl-N-(piperidin-2-ylmethyl)quinoxalin-2-amine
CID 106641225
N-cyclopropyl-4-methoxy-6-methyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 106640968
4-chloro-2-[cyclopropyl(piperidin-2-ylmethyl)amino]benzonitrile
CID 106641184
5-chloro-4-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-1H-pyrimidin-6-one
CID 136672454
N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
CID 106641172
N-cyclopropyl-5-nitro-N-(piperidin-2-ylmethyl)-1,3-thiazol-2-amine
CID 106641069
N-cyclopropyl-1-ethyl-N-(piperidin-2-ylmethyl)imidazol-2-amine
CID 106640976

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine (CID 106640995) is 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine is Clc1cnc(N(CC2CCCCN2)C2CC2)nc1.
What is the InChIKey of 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The InChIKey is ASHQNRAMKAKMHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN4/c14-10-7-16-13(17-8-10)18(12-4-5-12)9-11-3-1-2-6-15-11/h7-8,11-12,15H,1-6,9H2.
What are the key properties of 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine has a molecular weight of 266.78 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 106640995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).