5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine

C10H14ClN3O — CID 105369246

IUPAC5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
SMILESClc1cncnc1NCCC1CCCO1
InChIInChI=1S/C10H14ClN3O/c11-9-6-12-7-14-10(9)13-4-3-8-2-1-5-15-8/h6-8H,1-5H2,(H,12,13,14)
InChIKeyJZVYKJBKLVMNER-UHFFFAOYSA-N
MW227.69 g/mol
LogP2.11
Rot. Bonds4

About 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine

5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine (PubChem CID 105369246) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
PubChem CID105369246
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
SMILESClc1cncnc1NCCC1CCCO1
InChIInChI=1S/C10H14ClN3O/c11-9-6-12-7-14-10(9)13-4-3-8-2-1-5-15-8/h6-8H,1-5H2,(H,12,13,14)
InChIKeyJZVYKJBKLVMNER-UHFFFAOYSA-N
XLogP2.11
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-[2-(oxolan-2-yl)ethyl]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-[2-(oxolan-2-yl)ethylamino]pyrimidine-5-carbothioamide
CID 112755404
2-chloro-5-fluoro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 79081086
N'-(5-chloropyrimidin-4-yl)-N-cycloheptylethane-1,2-diamine
CID 105370083
N-[2-(oxan-2-yl)ethyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 103990755
5-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-2-amine
CID 63208180
5-chloro-N-(2-trimethylsilylethyl)pyrimidin-4-amine
CID 130993170
2-chloro-N-[2-(oxolan-2-yl)ethyl]-1,3-thiazol-4-amine
CID 131134692
6-N-ethyl-5-nitro-4-N-[2-(oxolan-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80812756
6-chloro-N-[2-(oxan-2-yl)ethyl]pyrazin-2-amine
CID 103990689
2-N-[2-(oxolan-2-yl)ethyl]pyrazine-2,5-diamine
CID 80652214
2-chloro-6-ethyl-N-[2-(oxolan-2-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 103321269
3-chloro-N-[2-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
CID 66482577

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine (CID 105369246) is 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine is Clc1cncnc1NCCC1CCCO1.
What is the InChIKey of 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
The InChIKey is JZVYKJBKLVMNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c11-9-6-12-7-14-10(9)13-4-3-8-2-1-5-15-8/h6-8H,1-5H2,(H,12,13,14).
What are the key properties of 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine?
5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine has a molecular weight of 227.69 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 105369246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).