(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone

C17H24N2O — CID 81457070

IUPAC(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
SMILESCCC1CN(C(=O)C2(c3ccccc3)CC2)CCC1N
InChIInChI=1S/C17H24N2O/c1-2-13-12-19(11-8-15(13)18)16(20)17(9-10-17)14-6-4-3-5-7-14/h3-7,13,15H,2,8-12,18H2,1H3
InChIKeyMMBAKBDTBPQJSY-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.30
Rot. Bonds3

About (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone

(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone (PubChem CID 81457070) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
PubChem CID81457070
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
SMILESCCC1CN(C(=O)C2(c3ccccc3)CC2)CCC1N
InChIInChI=1S/C17H24N2O/c1-2-13-12-19(11-8-15(13)18)16(20)17(9-10-17)14-6-4-3-5-7-14/h3-7,13,15H,2,8-12,18H2,1H3
InChIKeyMMBAKBDTBPQJSY-UHFFFAOYSA-N
XLogP2.30
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3S)-3-aminopyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119934201
(3-chloropyrrolidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 63394917
[(3R)-3-hydroxypyrrolidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 66262419
(4-amino-3-ethylpiperidin-1-yl)-(1-benzylcyclobutyl)methanone;hydrochloride
CID 155820492
methyl 1-(1-phenylcyclopropanecarbonyl)pyrrolidine-3-carboxylate
CID 78968034
(4-bromo-3-methylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 114683504
ethane;(4-methylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone
CID 144893493
1-(1-ethylsulfonyl-4-phenylpiperidine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 119354000
[4-(aminomethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 166001503
[4-(1-hydroxyethyl)piperidin-1-yl]-(1-phenylcyclopropyl)methanone
CID 103677890
[(3S)-1-(4-phenylpiperidine-4-carbonyl)pyrrolidin-3-yl]methanesulfonamide
CID 125167123
[4-(methylamino)piperidin-1-yl]-(1-phenylcyclopropyl)methanone;hydrochloride
CID 119560283

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone?
The IUPAC name of (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone (CID 81457070) is (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone?
The canonical SMILES for (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone is CCC1CN(C(=O)C2(c3ccccc3)CC2)CCC1N.
What is the InChIKey of (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone?
The InChIKey is MMBAKBDTBPQJSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-13-12-19(11-8-15(13)18)16(20)17(9-10-17)14-6-4-3-5-7-14/h3-7,13,15H,2,8-12,18H2,1H3.
What are the key properties of (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone?
(4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone has a molecular weight of 272.39 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-ethylpiperidin-1-yl)-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 81457070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).