[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine

C14H28N2 — CID 60974436

IUPAC[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine
SMILESCCC1CCCN1C1(CN)CCCC(C)C1
InChIInChI=1S/C14H28N2/c1-3-13-7-5-9-16(13)14(11-15)8-4-6-12(2)10-14/h12-13H,3-11,15H2,1-2H3
InChIKeyFMNZCJNYKGHWGZ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds3

About [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine

[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine (PubChem CID 60974436) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine
PubChem CID60974436
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine
SMILESCCC1CCCN1C1(CN)CCCC(C)C1
InChIInChI=1S/C14H28N2/c1-3-13-7-5-9-16(13)14(11-15)8-4-6-12(2)10-14/h12-13H,3-11,15H2,1-2H3
InChIKeyFMNZCJNYKGHWGZ-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107428917
[1-(2-ethylpiperidin-1-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
CID 64758210
[8-(2-ethylpyrrolidin-1-yl)spiro[4.5]decan-8-yl]methanamine
CID 114818062
[4-ethyl-1-(2-ethylpiperidin-1-yl)cycloheptyl]methanamine
CID 65088511
[1-(2-ethylpyrrolidin-1-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103562653
(3-methyl-1-pyrrolidin-1-ylcyclohexyl)methanamine
CID 24695310
[4-(2-ethylpiperidin-1-yl)-1-methylpiperidin-4-yl]methanamine
CID 43266395
[3-methyl-1-(2-propylpiperidin-1-yl)cyclobutyl]methanamine
CID 103563116
[1-(2-ethylpiperidin-1-yl)-3-methoxycyclobutyl]methanamine
CID 106821751
[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 63470394
[4-(2-ethylazepan-1-yl)thian-4-yl]methanamine
CID 104689235
[3-(2-ethylpiperidin-1-yl)-1,1-dioxothian-3-yl]methanamine
CID 63921849

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine?
The IUPAC name of [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine (CID 60974436) is [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine.
What is the SMILES notation for [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine?
The canonical SMILES for [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine is CCC1CCCN1C1(CN)CCCC(C)C1.
What is the InChIKey of [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine?
The InChIKey is FMNZCJNYKGHWGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-13-7-5-9-16(13)14(11-15)8-4-6-12(2)10-14/h12-13H,3-11,15H2,1-2H3.
What are the key properties of [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine?
[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine is sourced from PubChem (CID 60974436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).