3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine

C15H29N — CID 64623783

IUPAC3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine
SMILESCCC(NC1CCCC(C2CC2)C1)C(C)C
InChIInChI=1S/C15H29N/c1-4-15(11(2)3)16-14-7-5-6-13(10-14)12-8-9-12/h11-16H,4-10H2,1-3H3
InChIKeyBUTCYJPOZFMIDB-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds5

About 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine

3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine (PubChem CID 64623783) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine
PubChem CID64623783
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine
SMILESCCC(NC1CCCC(C2CC2)C1)C(C)C
InChIInChI=1S/C15H29N/c1-4-15(11(2)3)16-14-7-5-6-13(10-14)12-8-9-12/h11-16H,4-10H2,1-3H3
InChIKeyBUTCYJPOZFMIDB-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine?
The IUPAC name of 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine (CID 64623783) is 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine is CCC(NC1CCCC(C2CC2)C1)C(C)C.
What is the InChIKey of 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine?
The InChIKey is BUTCYJPOZFMIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-4-15(11(2)3)16-14-7-5-6-13(10-14)12-8-9-12/h11-16H,4-10H2,1-3H3.
What are the key properties of 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine?
3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(2-methylpentan-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 64623783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).