4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine

C15H23ClN2 — CID 113380658

IUPAC4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine
SMILESCCc1cc(CCl)cc(N(CC)C2CCCC2)n1
InChIInChI=1S/C15H23ClN2/c1-3-13-9-12(11-16)10-15(17-13)18(4-2)14-7-5-6-8-14/h9-10,14H,3-8,11H2,1-2H3
InChIKeyYAMPKGXXKXJNMT-UHFFFAOYSA-N
MW266.82 g/mol
LogP4.15
Rot. Bonds5

About 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine

4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine (PubChem CID 113380658) has the molecular formula C15H23ClN2 and a molecular weight of 266.82 g/mol. Its IUPAC name is 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine.

Molecular Properties

Compound Name4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine
PubChem CID113380658
Molecular FormulaC15H23ClN2
Molecular Weight266.82 g/mol
Exact Mass266.15
IUPAC Name4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine
SMILESCCc1cc(CCl)cc(N(CC)C2CCCC2)n1
InChIInChI=1S/C15H23ClN2/c1-3-13-9-12(11-16)10-15(17-13)18(4-2)14-7-5-6-8-14/h9-10,14H,3-8,11H2,1-2H3
InChIKeyYAMPKGXXKXJNMT-UHFFFAOYSA-N
XLogP4.15
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.82
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-(chloromethyl)-N-cyclohexyl-N-ethyl-2,6-difluoroaniline
CID 63540811
4-(aminomethyl)-N-cyclohexyl-N-ethyl-6-methylpyridin-2-amine
CID 113379299
6-(chloromethyl)-N-cyclohexyl-N-ethylpyridin-2-amine
CID 62254994
6-chloro-N-cyclohexyl-2-cyclopropyl-N-ethylpyrimidin-4-amine
CID 80949356
6-chloro-N-cyclohexyl-N-ethyl-2-propylpyrimidin-4-amine
CID 80940885
4-N-cyclohexyl-4-N,2-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80934243
6-(chloromethyl)-N-cyclopropyl-N-ethylpyridin-2-amine
CID 62255015
6-chloro-N-cyclopentyl-N-ethyl-2-(methoxymethyl)pyrimidin-4-amine
CID 113400832
6-chloro-N-cyclopropyl-N-ethyl-2-methylpyrimidin-4-amine
CID 62482724
6-chloro-N-cyclohexyl-N-ethylpyrimidin-4-amine
CID 53410294
4-(chloromethyl)-N-cyclopentyl-N-methylpyridin-2-amine
CID 61255965
2-[[6-ethyl-4-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
CID 102636123

Frequently Asked Questions

What is the IUPAC name of 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine?
The IUPAC name of 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine (CID 113380658) is 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine.
What is the SMILES notation for 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine?
The canonical SMILES for 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine is CCc1cc(CCl)cc(N(CC)C2CCCC2)n1.
What is the InChIKey of 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine?
The InChIKey is YAMPKGXXKXJNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2/c1-3-13-9-12(11-16)10-15(17-13)18(4-2)14-7-5-6-8-14/h9-10,14H,3-8,11H2,1-2H3.
What are the key properties of 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine?
4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine has a molecular weight of 266.82 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(chloromethyl)-N-cyclopentyl-N,6-diethylpyridin-2-amine is sourced from PubChem (CID 113380658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).