N-propylcyclohexanamine

C9H19N — CID 19178

IUPACN-propylcyclohexanamine
SMILESCCCNC1CCCCC1
InChIInChI=1S/C9H19N/c1-2-8-10-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3
InChIKeyPXKCSKRXWAZGFK-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.32
Rot. Bonds3

About N-propylcyclohexanamine

N-propylcyclohexanamine (PubChem CID 19178) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-propylcyclohexanamine.

Molecular Properties

Compound NameN-propylcyclohexanamine
PubChem CID19178
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-propylcyclohexanamine
SMILESCCCNC1CCCCC1
InChIInChI=1S/C9H19N/c1-2-8-10-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3
InChIKeyPXKCSKRXWAZGFK-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propylcyclohexanamine?
The IUPAC name of N-propylcyclohexanamine (CID 19178) is N-propylcyclohexanamine.
What is the SMILES notation for N-propylcyclohexanamine?
The canonical SMILES for N-propylcyclohexanamine is CCCNC1CCCCC1.
What is the InChIKey of N-propylcyclohexanamine?
The InChIKey is PXKCSKRXWAZGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-2-8-10-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3.
What are the key properties of N-propylcyclohexanamine?
N-propylcyclohexanamine has a molecular weight of 141.26 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylcyclohexanamine is sourced from PubChem (CID 19178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).