2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine

C10H18N2 — CID 67561865

IUPAC2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine
SMILESC=C(C)NC1=C(CN)CCCC1
InChIInChI=1S/C10H18N2/c1-8(2)12-10-6-4-3-5-9(10)7-11/h12H,1,3-7,11H2,2H3
InChIKeyVCKGOHNZVDZOKD-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds3

About 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine

2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine (PubChem CID 67561865) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine
PubChem CID67561865
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine
SMILESC=C(C)NC1=C(CN)CCCC1
InChIInChI=1S/C10H18N2/c1-8(2)12-10-6-4-3-5-9(10)7-11/h12H,1,3-7,11H2,2H3
InChIKeyVCKGOHNZVDZOKD-UHFFFAOYSA-N
XLogP1.90
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine?
The IUPAC name of 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine (CID 67561865) is 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine is C=C(C)NC1=C(CN)CCCC1.
What is the InChIKey of 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine?
The InChIKey is VCKGOHNZVDZOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-8(2)12-10-6-4-3-5-9(10)7-11/h12H,1,3-7,11H2,2H3.
What are the key properties of 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine?
2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine has a molecular weight of 166.27 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-prop-1-en-2-ylcyclohexen-1-amine is sourced from PubChem (CID 67561865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).