N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine

C15H29N — CID 63995128

IUPACN-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine
SMILESCCC(CC1CC1)NC1CCCCC1CC
InChIInChI=1S/C15H29N/c1-3-13-7-5-6-8-15(13)16-14(4-2)11-12-9-10-12/h12-16H,3-11H2,1-2H3
InChIKeyZYOBMRWRHLRHNG-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.12
Rot. Bonds6

About N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine

N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine (PubChem CID 63995128) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine
PubChem CID63995128
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine
SMILESCCC(CC1CC1)NC1CCCCC1CC
InChIInChI=1S/C15H29N/c1-3-13-7-5-6-8-15(13)16-14(4-2)11-12-9-10-12/h12-16H,3-11H2,1-2H3
InChIKeyZYOBMRWRHLRHNG-UHFFFAOYSA-N
XLogP4.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine?
The IUPAC name of N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine (CID 63995128) is N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine.
What is the SMILES notation for N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine?
The canonical SMILES for N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine is CCC(CC1CC1)NC1CCCCC1CC.
What is the InChIKey of N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine?
The InChIKey is ZYOBMRWRHLRHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-3-13-7-5-6-8-15(13)16-14(4-2)11-12-9-10-12/h12-16H,3-11H2,1-2H3.
What are the key properties of N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine?
N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylbutan-2-yl)-2-ethylcyclohexan-1-amine is sourced from PubChem (CID 63995128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).