1-cyclohexyl-N-methylpropan-2-amine

C10H21N — CID 7558

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IUPAC1-cyclohexyl-N-methylpropan-2-amine
SMILESCNC(C)CC1CCCCC1
InChIInChI=1S/C10H21N/c1-9(11-2)8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChIKeyJCRIVQIOJSSCQD-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.56
Rot. Bonds3

About 1-cyclohexyl-N-methylpropan-2-amine

1-cyclohexyl-N-methylpropan-2-amine (PubChem CID 7558) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-cyclohexyl-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-methylpropan-2-amine
PubChem CID7558
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-cyclohexyl-N-methylpropan-2-amine
SMILESCNC(C)CC1CCCCC1
InChIInChI=1S/C10H21N/c1-9(11-2)8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChIKeyJCRIVQIOJSSCQD-UHFFFAOYSA-N
XLogP2.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methylpropan-2-amine?
The IUPAC name of 1-cyclohexyl-N-methylpropan-2-amine (CID 7558) is 1-cyclohexyl-N-methylpropan-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-methylpropan-2-amine?
The canonical SMILES for 1-cyclohexyl-N-methylpropan-2-amine is CNC(C)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-methylpropan-2-amine?
The InChIKey is JCRIVQIOJSSCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-9(11-2)8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-methylpropan-2-amine?
1-cyclohexyl-N-methylpropan-2-amine has a molecular weight of 155.28 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methylpropan-2-amine is sourced from PubChem (CID 7558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).