3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide

C15H23N3O — CID 122081114

IUPAC3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide
SMILESCC1CCNCC1NC(=O)CC(N)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-11-7-8-17-10-14(11)18-15(19)9-13(16)12-5-3-2-4-6-12/h2-6,11,13-14,17H,7-10,16H2,1H3,(H,18,19)
InChIKeySOPCPRIJGHETIF-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.19
Rot. Bonds4

About 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide

3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide (PubChem CID 122081114) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide
PubChem CID122081114
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide
SMILESCC1CCNCC1NC(=O)CC(N)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-11-7-8-17-10-14(11)18-15(19)9-13(16)12-5-3-2-4-6-12/h2-6,11,13-14,17H,7-10,16H2,1H3,(H,18,19)
InChIKeySOPCPRIJGHETIF-UHFFFAOYSA-N
XLogP1.19
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpiperidin-3-yl)benzamide
CID 63326220
2-[(3-amino-3-phenylpropanoyl)amino]cyclohexane-1-carboxylic acid
CID 64816023
3-amino-N-(1,3-dimethylpiperidin-4-yl)-3-phenylpropanamide
CID 115748935
benzyl N-[(3S,4R)-4-methylpiperidin-3-yl]carbamate
CID 97357162
2-bromo-N-(4-methylpiperidin-3-yl)acetamide
CID 165439704
3-amino-3-phenyl-N-(2-phenyloxolan-3-yl)propanamide
CID 119952210
3-amino-N-[2-(aminomethyl)cyclohexyl]-3-phenylpropanamide
CID 122080744
4-[(3-amino-3-phenylpropanoyl)amino]cyclohexane-1-carboxylic acid
CID 61160281
N-(3-methylpiperidin-4-yl)-2-phenylacetamide;hydrochloride
CID 120553778
4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride
CID 119424594
3-amino-N-(1-benzyl-3,5-dimethylpiperidin-4-yl)-3-phenylpropanamide
CID 119953982
3-amino-3-phenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
CID 43711347

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide?
The IUPAC name of 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide (CID 122081114) is 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide is CC1CCNCC1NC(=O)CC(N)c1ccccc1.
What is the InChIKey of 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide?
The InChIKey is SOPCPRIJGHETIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-7-8-17-10-14(11)18-15(19)9-13(16)12-5-3-2-4-6-12/h2-6,11,13-14,17H,7-10,16H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide?
3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide has a molecular weight of 261.37 g/mol, XLogP of 1.19, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-methylpiperidin-3-yl)-3-phenylpropanamide is sourced from PubChem (CID 122081114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).