6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine

C14H23ClN4 — CID 80971369

IUPAC6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
SMILESCCc1nc(Cl)c(C)c(N(C)C2CCCN(C)C2)n1
InChIInChI=1S/C14H23ClN4/c1-5-12-16-13(15)10(2)14(17-12)19(4)11-7-6-8-18(3)9-11/h11H,5-9H2,1-4H3
InChIKeyDUYFSSWYMNHCDD-UHFFFAOYSA-N
MW282.82 g/mol
LogP2.53
Rot. Bonds3

About 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine

6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine (PubChem CID 80971369) has the molecular formula C14H23ClN4 and a molecular weight of 282.82 g/mol. Its IUPAC name is 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
PubChem CID80971369
Molecular FormulaC14H23ClN4
Molecular Weight282.82 g/mol
Exact Mass282.16
IUPAC Name6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
SMILESCCc1nc(Cl)c(C)c(N(C)C2CCCN(C)C2)n1
InChIInChI=1S/C14H23ClN4/c1-5-12-16-13(15)10(2)14(17-12)19(4)11-7-6-8-18(3)9-11/h11H,5-9H2,1-4H3
InChIKeyDUYFSSWYMNHCDD-UHFFFAOYSA-N
XLogP2.53
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N,5-dimethyl-N-(1-methylpiperidin-3-yl)-2-propylpyrimidin-4-amine
CID 80972660
6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-4-yl)pyrimidin-4-amine
CID 80970385
6-chloro-N,5-dimethyl-N-(1-methylpiperidin-3-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80971453
3,6-dichloro-N-methyl-N-(1-methylpiperidin-3-yl)-1,2,4-triazin-5-amine
CID 81036366
6-chloro-N-methyl-N-(1-methylpiperidin-3-yl)-5-propylpyrimidin-4-amine
CID 63729519
1-[1-(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 80971751
5-chloro-4-N-methyl-4-N-(1-methylpiperidin-3-yl)-2-N-propylpyrimidine-2,4-diamine
CID 80832102
6-chloro-N-(4,4-dimethylcyclohexyl)-N,5-dimethyl-2-propylpyrimidin-4-amine
CID 80970871
3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine
CID 62673591
[4-chloro-2-[methyl-(1-methylpiperidin-3-yl)amino]-1,3-thiazol-5-yl]methanol
CID 80692409
2-chloro-N-methyl-N-(1-methylpiperidin-3-yl)quinazolin-4-amine
CID 62545795
5-chloro-4-[methyl-(1-methylpiperidin-3-yl)amino]-1H-pyrimidin-6-one
CID 136971235

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine?
The IUPAC name of 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine (CID 80971369) is 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine is CCc1nc(Cl)c(C)c(N(C)C2CCCN(C)C2)n1.
What is the InChIKey of 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine?
The InChIKey is DUYFSSWYMNHCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN4/c1-5-12-16-13(15)10(2)14(17-12)19(4)11-7-6-8-18(3)9-11/h11H,5-9H2,1-4H3.
What are the key properties of 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine?
6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine has a molecular weight of 282.82 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 80971369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).