3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide

C17H25N3O — CID 43711758

IUPAC3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
SMILESNC(CC(=O)NC1CCN(C2CC2)CC1)c1ccccc1
InChIInChI=1S/C17H25N3O/c18-16(13-4-2-1-3-5-13)12-17(21)19-14-8-10-20(11-9-14)15-6-7-15/h1-5,14-16H,6-12,18H2,(H,19,21)
InChIKeyVXNQNZQFNJWOCW-UHFFFAOYSA-N
MW287.41 g/mol
LogP1.82
Rot. Bonds5

About 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide

3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide (PubChem CID 43711758) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
PubChem CID43711758
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
SMILESNC(CC(=O)NC1CCN(C2CC2)CC1)c1ccccc1
InChIInChI=1S/C17H25N3O/c18-16(13-4-2-1-3-5-13)12-17(21)19-14-8-10-20(11-9-14)15-6-7-15/h1-5,14-16H,6-12,18H2,(H,19,21)
InChIKeyVXNQNZQFNJWOCW-UHFFFAOYSA-N
XLogP1.82
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-phenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
CID 43711347
3-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-phenylpropanamide;hydrochloride
CID 119949354
4-amino-N-(1-cyclopropylpyrrolidin-3-yl)-4-phenylbutanamide
CID 63324219
3-amino-3-phenyl-N-(1-prop-2-enylpiperidin-4-yl)propanamide
CID 119953733
4-[(3-amino-3-phenylpropanoyl)amino]cyclohexane-1-carboxylic acid
CID 61160281
3-amino-3-phenyl-N-[1-(2-phenylbutanoyl)piperidin-4-yl]propanamide
CID 119950959
3-amino-3-phenyl-N-(4-phenylcyclohexyl)propanamide;hydrochloride
CID 119949671
3-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-3-phenylpropanamide;dihydrochloride
CID 119953381
3-amino-N-[1-(oxolan-3-ylmethyl)piperidin-4-yl]-3-phenylpropanamide
CID 119953980
(2R)-2-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide
CID 78984552
3-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-3-phenylpropanamide
CID 79401824
3-amino-N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-3-phenylpropanamide;dihydrochloride
CID 119954156

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide (CID 43711758) is 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide is NC(CC(=O)NC1CCN(C2CC2)CC1)c1ccccc1.
What is the InChIKey of 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide?
The InChIKey is VXNQNZQFNJWOCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c18-16(13-4-2-1-3-5-13)12-17(21)19-14-8-10-20(11-9-14)15-6-7-15/h1-5,14-16H,6-12,18H2,(H,19,21).
What are the key properties of 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide?
3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide has a molecular weight of 287.41 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-cyclopropylpiperidin-4-yl)-3-phenylpropanamide is sourced from PubChem (CID 43711758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).