1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine

C15H29N — CID 104986481

IUPAC1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
SMILESCCNC(CC1CCCCCC1)CC1CC1
InChIInChI=1S/C15H29N/c1-2-16-15(12-14-9-10-14)11-13-7-5-3-4-6-8-13/h13-16H,2-12H2,1H3
InChIKeyQMWGVRHSLVUNGJ-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.13
Rot. Bonds6

About 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine

1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine (PubChem CID 104986481) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
PubChem CID104986481
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine
SMILESCCNC(CC1CCCCCC1)CC1CC1
InChIInChI=1S/C15H29N/c1-2-16-15(12-14-9-10-14)11-13-7-5-3-4-6-8-13/h13-16H,2-12H2,1H3
InChIKeyQMWGVRHSLVUNGJ-UHFFFAOYSA-N
XLogP4.13
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 ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 62601705
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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine?
The IUPAC name of 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine (CID 104986481) is 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine.
What is the SMILES notation for 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine?
The canonical SMILES for 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine is CCNC(CC1CCCCCC1)CC1CC1.
What is the InChIKey of 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine?
The InChIKey is QMWGVRHSLVUNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-2-16-15(12-14-9-10-14)11-13-7-5-3-4-6-8-13/h13-16H,2-12H2,1H3.
What are the key properties of 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine?
1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine has a molecular weight of 223.40 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-3-cyclopropyl-N-ethylpropan-2-amine is sourced from PubChem (CID 104986481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).