5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine

C10H15ClN4 — CID 103724805

IUPAC5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine
SMILESCN1CCCC1CNc1ncc(Cl)cn1
InChIInChI=1S/C10H15ClN4/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyMQAWCLJCLZKRKH-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.64
Rot. Bonds3

About 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine

5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine (PubChem CID 103724805) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine
PubChem CID103724805
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine
SMILESCN1CCCC1CNc1ncc(Cl)cn1
InChIInChI=1S/C10H15ClN4/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyMQAWCLJCLZKRKH-UHFFFAOYSA-N
XLogP1.64
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]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

2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
CID 106022717
3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
CID 106026698
5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazin-2-amine
CID 131214051
4-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 142876099
6-chloro-4-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 106029018
3,4-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 83962864
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,4-diamine
CID 106028625
5-chloro-2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 114138477
5-bromo-2-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 106026101
1-methyl-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]pyrazol-4-amine
CID 155225172
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazine-2,5-diamine
CID 106028605
6-chloro-2-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-2,4-diamine
CID 106022889

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine?
The IUPAC name of 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine (CID 103724805) is 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine?
The canonical SMILES for 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine is CN1CCCC1CNc1ncc(Cl)cn1.
What is the InChIKey of 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine?
The InChIKey is MQAWCLJCLZKRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3,(H,12,13,14).
What are the key properties of 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine?
5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine has a molecular weight of 226.71 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 103724805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).