4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine

C13H26N2 — CID 62616060

IUPAC4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(N)C(CN2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-2-11-5-6-13(14)12(9-11)10-15-7-3-4-8-15/h11-13H,2-10,14H2,1H3
InChIKeyWCTSTMBGMCGHOU-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.24
Rot. Bonds3

About 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine

4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine (PubChem CID 62616060) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
PubChem CID62616060
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(N)C(CN2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-2-11-5-6-13(14)12(9-11)10-15-7-3-4-8-15/h11-13H,2-10,14H2,1H3
InChIKeyWCTSTMBGMCGHOU-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-2-[(4-methylazepan-1-yl)methyl]cyclohexan-1-amine
CID 63623585
4-ethyl-2-[(3-ethylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 62616464
2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
CID 63495460
2-[[4-[(dimethylamino)methyl]piperidin-1-yl]methyl]-4-ethylcyclohexan-1-amine
CID 62609457
2-[(2,2-dimethylpyrrolidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
CID 63218173
2-[(4-ethylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 62609501
2-[1-[(2-amino-5-ethylcyclohexyl)methyl]piperidin-2-yl]ethanol
CID 55093548
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)-4-ethylcyclohexan-1-amine
CID 82751935
2-(piperidin-1-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 55208973
2-(pyrrolidin-1-ylmethyl)cyclopentan-1-amine
CID 23009063
2-(azepan-1-ylmethyl)cycloheptan-1-amine
CID 62616403
4-ethyl-N-methyl-2-[(4-methylazepan-1-yl)methyl]cyclohexan-1-amine
CID 55249988

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine (CID 62616060) is 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine is CCC1CCC(N)C(CN2CCCC2)C1.
What is the InChIKey of 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine?
The InChIKey is WCTSTMBGMCGHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-11-5-6-13(14)12(9-11)10-15-7-3-4-8-15/h11-13H,2-10,14H2,1H3.
What are the key properties of 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine?
4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 62616060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).