1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine

C11H22N2 — CID 62069621

IUPAC1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine
SMILESNCC1(NC2CC2)CCCCCC1
InChIInChI=1S/C11H22N2/c12-9-11(13-10-5-6-10)7-3-1-2-4-8-11/h10,13H,1-9,12H2
InChIKeyHEGNJYLXDHAZPP-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.79
Rot. Bonds3

About 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine

1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine (PubChem CID 62069621) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine
PubChem CID62069621
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine
SMILESNCC1(NC2CC2)CCCCCC1
InChIInChI=1S/C11H22N2/c12-9-11(13-10-5-6-10)7-3-1-2-4-8-11/h10,13H,1-9,12H2
InChIKeyHEGNJYLXDHAZPP-UHFFFAOYSA-N
XLogP1.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-N2-(cycloheptylmethyl)-N1-((R)-1-(methylamino)pentan-2-yl)pentane-1,2-diamine
CID 45482174
1-(aminomethyl)-N-(2,2,2-trifluoroethyl)cycloheptan-1-amine
CID 65379060
1-(aminomethyl)-N-(2,2-difluoroethyl)cycloheptan-1-amine
CID 115406270
1-(aminomethyl)-N-ethylcycloheptan-1-amine
CID 21027190
1-(aminomethyl)-N,N-diethylcycloheptan-1-amine
CID 21027192
1-Cyclopropylamino-cycloheptanecarbonitrile
CID 43151664
2-Cycloheptylpiperazine
CID 53732847
(2R)-3-cycloheptyl-1-N,1-N-dimethyl-2-N-propan-2-ylpropane-1,2-diamine
CID 58598112
1-methyl-N-propan-2-ylcycloheptan-1-amine
CID 59833055
1-(Aminomethyl)-n-methylcycloheptanamine
CID 62064262
1-(aminomethyl)-N-propan-2-ylcyclooctan-1-amine
CID 62065123
1-(aminomethyl)-N-cyclopropylcyclohexan-1-amine
CID 62070684

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine (CID 62069621) is 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine is NCC1(NC2CC2)CCCCCC1.
What is the InChIKey of 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine?
The InChIKey is HEGNJYLXDHAZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c12-9-11(13-10-5-6-10)7-3-1-2-4-8-11/h10,13H,1-9,12H2.
What are the key properties of 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine?
1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-cyclopropylcycloheptan-1-amine is sourced from PubChem (CID 62069621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).