4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

C11H16ClN3 — CID 61382065

IUPAC4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESCCN(CC)c1nc(Cl)c2c(n1)CCC2
InChIInChI=1S/C11H16ClN3/c1-3-15(4-2)11-13-9-7-5-6-8(9)10(12)14-11/h3-7H2,1-2H3
InChIKeyWLVZMDUHVCDSQW-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.46
Rot. Bonds3

About 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (PubChem CID 61382065) has the molecular formula C11H16ClN3 and a molecular weight of 225.72 g/mol. Its IUPAC name is 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
PubChem CID61382065
Molecular FormulaC11H16ClN3
Molecular Weight225.72 g/mol
Exact Mass225.10
IUPAC Name4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
SMILESCCN(CC)c1nc(Cl)c2c(n1)CCC2
InChIInChI=1S/C11H16ClN3/c1-3-15(4-2)11-13-9-7-5-6-8(9)10(12)14-11/h3-7H2,1-2H3
InChIKeyWLVZMDUHVCDSQW-UHFFFAOYSA-N
XLogP2.46
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]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

4-chloro-N-methyl-N-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
CID 94674621
1-(4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-N,N-dimethylmethanamine
CID 79078275
2-(4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-N,N-dimethylethanamine
CID 115345603
4-chloro-2-methyl-5,6,7,8-tetrahydroquinazoline
CID 19744207
4-chloro-2-(2,2-dimethylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 63891705
4,6-dichloro-N,N-diethyl-5-propylpyrimidin-2-amine
CID 63612489
N,N-diethyl-4-methoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-2-amine
CID 117101191
6-chloro-2-N,2-N,4-N,4-N-tetraethyl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 172755084
4-chloro-2-(2,2,2-trifluoroethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 61392950
4-chloro-2-(5-ethylthiophen-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 62320899
4-chloro-2-(4-methylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 66525398
4-chloro-2-(3-ethyl-1,4-dithian-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 113299213

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The IUPAC name of 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine (CID 61382065) is 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine.
What is the SMILES notation for 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The canonical SMILES for 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is CCN(CC)c1nc(Cl)c2c(n1)CCC2.
What is the InChIKey of 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
The InChIKey is WLVZMDUHVCDSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3/c1-3-15(4-2)11-13-9-7-5-6-8(9)10(12)14-11/h3-7H2,1-2H3.
What are the key properties of 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine?
4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine has a molecular weight of 225.72 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-diethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine is sourced from PubChem (CID 61382065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).