4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine

C14H28N2 — CID 114763444

IUPAC4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCC(N2CC(C)C(C)C2)CC1
InChIInChI=1S/C14H28N2/c1-4-15-13-5-7-14(8-6-13)16-9-11(2)12(3)10-16/h11-15H,4-10H2,1-3H3
InChIKeyBQAZTXRUCMDWES-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds3

About 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine

4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine (PubChem CID 114763444) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine
PubChem CID114763444
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCC(N2CC(C)C(C)C2)CC1
InChIInChI=1S/C14H28N2/c1-4-15-13-5-7-14(8-6-13)16-9-11(2)12(3)10-16/h11-15H,4-10H2,1-3H3
InChIKeyBQAZTXRUCMDWES-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-methylazetidin-1-yl)-N-propylcyclohexan-1-amine
CID 79687379
N-ethylcyclopropanamine;hydrochloride
CID 43810659
N-ethyl-1-(4-methylcyclohexyl)pyrrolidin-3-amine
CID 43315476
N-ethyl-4-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 114763207
1-cyclopentyl-N-ethylpiperidin-4-amine
CID 43315368
1-cyclopropyl-5-(ethylamino)piperidine-3-carboxylic acid
CID 83990502
1-cyclopropyl-N-ethyl-5-propylpiperidin-3-amine
CID 83990496
N-ethyl-4-[3-(trifluoromethyl)piperidin-1-yl]cyclohexan-1-amine
CID 114763404
1-[4-(ethylamino)cyclohexyl]piperidine-4-carboxamide
CID 114762750
8-(2,3-dimethylcyclopentyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 64922280
N-ethyl-3-piperidin-1-ylcyclopentan-1-amine
CID 79643289
N-ethyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 114762762

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine?
The IUPAC name of 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine (CID 114763444) is 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine.
What is the SMILES notation for 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine?
The canonical SMILES for 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine is CCNC1CCC(N2CC(C)C(C)C2)CC1.
What is the InChIKey of 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine?
The InChIKey is BQAZTXRUCMDWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-15-13-5-7-14(8-6-13)16-9-11(2)12(3)10-16/h11-15H,4-10H2,1-3H3.
What are the key properties of 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine?
4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethylpyrrolidin-1-yl)-N-ethylcyclohexan-1-amine is sourced from PubChem (CID 114763444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).