2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine

C14H18ClN5 — CID 143437660

IUPAC2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
SMILESCCN(C)c1cc(NCCc2ccccn2)nc(Cl)n1
InChIInChI=1S/C14H18ClN5/c1-3-20(2)13-10-12(18-14(15)19-13)17-9-7-11-6-4-5-8-16-11/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18,19)
InChIKeyIGUIFKPUNOJIGG-UHFFFAOYSA-N
MW291.79 g/mol
LogP2.64
Rot. Bonds6

About 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine

2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine (PubChem CID 143437660) has the molecular formula C14H18ClN5 and a molecular weight of 291.79 g/mol. Its IUPAC name is 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
PubChem CID143437660
Molecular FormulaC14H18ClN5
Molecular Weight291.79 g/mol
Exact Mass291.13
IUPAC Name2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
SMILESCCN(C)c1cc(NCCc2ccccn2)nc(Cl)n1
InChIInChI=1S/C14H18ClN5/c1-3-20(2)13-10-12(18-14(15)19-13)17-9-7-11-6-4-5-8-16-11/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18,19)
InChIKeyIGUIFKPUNOJIGG-UHFFFAOYSA-N
XLogP2.64
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.79
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-2-ethyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80943258
6-N-ethyl-2-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80938770
4,6-dichloro-N-(2-pyridin-2-ylethyl)-1,3,5-triazin-2-amine
CID 58508167
6-N-methyl-2-propyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80945511
2,6-dimethyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 60725788
4-chloro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 19432992
2-[methyl-[6-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]amino]acetonitrile
CID 115266242
3,5-dichloro-2-N-ethyl-6-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
CID 102755416
2-chloro-6-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 62476257
2-phenyl-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 155900200
6-hydrazinyl-N-methyl-2-propyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80944141
5-methyl-N-(2-pyridin-2-ylethyl)pyridazin-3-amine
CID 106549424

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The IUPAC name of 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine (CID 143437660) is 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The canonical SMILES for 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine is CCN(C)c1cc(NCCc2ccccn2)nc(Cl)n1.
What is the InChIKey of 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
The InChIKey is IGUIFKPUNOJIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN5/c1-3-20(2)13-10-12(18-14(15)19-13)17-9-7-11-6-4-5-8-16-11/h4-6,8,10H,3,7,9H2,1-2H3,(H,17,18,19).
What are the key properties of 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine?
2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine has a molecular weight of 291.79 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-N-ethyl-4-N-methyl-6-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 143437660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).