2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine

C18H28N2 — CID 79984560

IUPAC2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCCCN1C(CN)c1ccc(C2CC2)cc1
InChIInChI=1S/C18H28N2/c1-2-17-5-3-4-12-20(17)18(13-19)16-10-8-15(9-11-16)14-6-7-14/h8-11,14,17-18H,2-7,12-13,19H2,1H3
InChIKeyHBDSSUMZVUUCCF-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.83
Rot. Bonds5

About 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine

2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine (PubChem CID 79984560) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
PubChem CID79984560
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
SMILESCCC1CCCCN1C(CN)c1ccc(C2CC2)cc1
InChIInChI=1S/C18H28N2/c1-2-17-5-3-4-12-20(17)18(13-19)16-10-8-15(9-11-16)14-6-7-14/h8-11,14,17-18H,2-7,12-13,19H2,1H3
InChIKeyHBDSSUMZVUUCCF-UHFFFAOYSA-N
XLogP3.83
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylpiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 43266345
2-(2-ethylpiperidin-1-yl)-2-phenylethanamine
CID 43266409
2-[4-(difluoromethyl)phenyl]-2-(2-ethylazepan-1-yl)ethanamine
CID 104689206
2-(4-cyclopropylphenyl)-2-(3-ethylmorpholin-4-yl)ethanamine
CID 79983720
2-(2-ethylpiperidin-1-yl)-2-(4-propan-2-yloxyphenyl)ethanamine
CID 60916800
2-(3,4-dimethylphenyl)-2-(2-ethylazepan-1-yl)ethanamine
CID 104689217
2-(3,4-difluorophenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
CID 43266330
2-(3-bromo-4-methylphenyl)-2-(2-ethylazepan-1-yl)ethanamine
CID 105405177
2-(3-bromophenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
CID 43266358
2-(2-ethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 43266319
2-(azepan-1-yl)-2-(4-cyclopropylphenyl)ethanamine
CID 79984707
2-(2,6-dichlorophenyl)-2-(2-ethylazepan-1-yl)ethanamine
CID 104689325

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine (CID 79984560) is 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine is CCC1CCCCN1C(CN)c1ccc(C2CC2)cc1.
What is the InChIKey of 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine?
The InChIKey is HBDSSUMZVUUCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-2-17-5-3-4-12-20(17)18(13-19)16-10-8-15(9-11-16)14-6-7-14/h8-11,14,17-18H,2-7,12-13,19H2,1H3.
What are the key properties of 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine?
2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine has a molecular weight of 272.44 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 79984560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).