N,N,4,4,6-pentamethylcyclohexen-1-amine

C11H21N — CID 70636196

IUPACN,N,4,4,6-pentamethylcyclohexen-1-amine
SMILESCC1CC(C)(C)CC=C1N(C)C
InChIInChI=1S/C11H21N/c1-9-8-11(2,3)7-6-10(9)12(4)5/h6,9H,7-8H2,1-5H3
InChIKeyKHQSZNNTGQUHGI-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.89
Rot. Bonds1

About N,N,4,4,6-pentamethylcyclohexen-1-amine

N,N,4,4,6-pentamethylcyclohexen-1-amine (PubChem CID 70636196) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N,N,4,4,6-pentamethylcyclohexen-1-amine.

Molecular Properties

Compound NameN,N,4,4,6-pentamethylcyclohexen-1-amine
PubChem CID70636196
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN,N,4,4,6-pentamethylcyclohexen-1-amine
SMILESCC1CC(C)(C)CC=C1N(C)C
InChIInChI=1S/C11H21N/c1-9-8-11(2,3)7-6-10(9)12(4)5/h6,9H,7-8H2,1-5H3
InChIKeyKHQSZNNTGQUHGI-UHFFFAOYSA-N
XLogP2.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,4,4,6-pentamethylcyclohexen-1-amine?
The IUPAC name of N,N,4,4,6-pentamethylcyclohexen-1-amine (CID 70636196) is N,N,4,4,6-pentamethylcyclohexen-1-amine.
What is the SMILES notation for N,N,4,4,6-pentamethylcyclohexen-1-amine?
The canonical SMILES for N,N,4,4,6-pentamethylcyclohexen-1-amine is CC1CC(C)(C)CC=C1N(C)C.
What is the InChIKey of N,N,4,4,6-pentamethylcyclohexen-1-amine?
The InChIKey is KHQSZNNTGQUHGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9-8-11(2,3)7-6-10(9)12(4)5/h6,9H,7-8H2,1-5H3.
What are the key properties of N,N,4,4,6-pentamethylcyclohexen-1-amine?
N,N,4,4,6-pentamethylcyclohexen-1-amine has a molecular weight of 167.30 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4,4,6-pentamethylcyclohexen-1-amine is sourced from PubChem (CID 70636196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).