N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide

C15H20N2O — CID 102234848

IUPACN-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)C1=CCCCC1
InChIInChI=1S/C15H20N2O/c1-2-17(12-13-8-10-16-11-9-13)15(18)14-6-4-3-5-7-14/h6,8-11H,2-5,7,12H2,1H3
InChIKeyJHAHCIDOMIIKNC-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.93
Rot. Bonds4

About N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide

N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide (PubChem CID 102234848) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide
PubChem CID102234848
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide
SMILESCCN(Cc1ccncc1)C(=O)C1=CCCCC1
InChIInChI=1S/C15H20N2O/c1-2-17(12-13-8-10-16-11-9-13)15(18)14-6-4-3-5-7-14/h6,8-11H,2-5,7,12H2,1H3
InChIKeyJHAHCIDOMIIKNC-UHFFFAOYSA-N
XLogP2.93
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide 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

N,N-dibenzylcycloheptene-1-carboxamide
CID 101069096
2-[[ethyl(pyridin-4-ylmethyl)carbamoyl]amino]acetic acid
CID 61449449
2-amino-N-ethyl-4-methyl-N-(pyridin-4-ylmethyl)-1,3-thiazole-5-carboxamide
CID 55115723
4-chloro-N-ethyl-6-methyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 81227477
N-ethyl-4-(2-methylbutan-2-yl)-N-(pyridin-4-ylmethyl)benzamide
CID 130315749
N,N-dimethylcyclohexene-1-carboxamide
CID 11019067
2-bromo-N-ethyl-N-(pyridin-4-ylmethyl)propanamide
CID 107904597
3-amino-N-ethyl-N-(pyridin-4-ylmethyl)benzamide
CID 54905832
N-ethyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 564270
(2R)-N-ethyl-N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 93375226
N-ethyl-3,4-dimethoxy-N-(pyridin-4-ylmethyl)benzamide
CID 6470450
2-(aminomethyl)-N-ethyl-2-methyl-N-(pyridin-4-ylmethyl)butanamide
CID 114290465

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide?
The IUPAC name of N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide (CID 102234848) is N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide.
What is the SMILES notation for N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide?
The canonical SMILES for N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide is CCN(Cc1ccncc1)C(=O)C1=CCCCC1.
What is the InChIKey of N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide?
The InChIKey is JHAHCIDOMIIKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-2-17(12-13-8-10-16-11-9-13)15(18)14-6-4-3-5-7-14/h6,8-11H,2-5,7,12H2,1H3.
What are the key properties of N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide?
N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 2.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(pyridin-4-ylmethyl)cyclohexene-1-carboxamide is sourced from PubChem (CID 102234848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).