1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine

C12H24N2 — CID 114616252

IUPAC1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine
SMILESC=C(C)CNC1(CN)CCC(CC)C1
InChIInChI=1S/C12H24N2/c1-4-11-5-6-12(7-11,9-13)14-8-10(2)3/h11,14H,2,4-9,13H2,1,3H3
InChIKeySJNGFGUZOKNIEL-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.06
Rot. Bonds5

About 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine

1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine (PubChem CID 114616252) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine
PubChem CID114616252
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine
SMILESC=C(C)CNC1(CN)CCC(CC)C1
InChIInChI=1S/C12H24N2/c1-4-11-5-6-12(7-11,9-13)14-8-10(2)3/h11,14H,2,4-9,13H2,1,3H3
InChIKeySJNGFGUZOKNIEL-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(aminomethyl)-2-ethyl-N-(2-methylprop-2-enyl)oxan-4-amine
CID 114616093
1-(aminomethyl)-3-ethyl-N-(2-methoxypropyl)cyclohexan-1-amine
CID 102697177
1-(aminomethyl)-4-ethyl-N-(3-methyl-2-propan-2-ylbutyl)cyclohexan-1-amine
CID 102912303
N-[1-(aminomethyl)-3-ethylcyclopentyl]morpholin-4-amine
CID 83013895
1-(aminomethyl)-4-ethyl-1-(sulfamoylamino)cyclohexane
CID 28940754
3-(aminomethyl)-N-(2-methylprop-2-enyl)thian-3-amine
CID 114616209
1-(aminomethyl)-2-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine
CID 106872782
1-(aminomethyl)-N-(2-methylprop-2-enyl)-2-propan-2-ylcyclohexan-1-amine
CID 114616224
(3-ethyl-1-methylcyclopentyl)methanamine
CID 65407293
1-(aminomethyl)-N-cyclohexyl-3-ethylcyclohexan-1-amine
CID 65383479
N-[1-(aminomethyl)-4-ethylcyclohexyl]cycloheptanamine
CID 65379539
1-(aminomethyl)-4-ethyl-N-prop-2-ynylcycloheptan-1-amine
CID 65380981

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine (CID 114616252) is 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine is C=C(C)CNC1(CN)CCC(CC)C1.
What is the InChIKey of 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine?
The InChIKey is SJNGFGUZOKNIEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-11-5-6-12(7-11,9-13)14-8-10(2)3/h11,14H,2,4-9,13H2,1,3H3.
What are the key properties of 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine?
1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-3-ethyl-N-(2-methylprop-2-enyl)cyclopentan-1-amine is sourced from PubChem (CID 114616252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).