N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide

C16H25N3O — CID 63161794

IUPACN-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide
SMILESCCC1(C)CCN(C(=O)Nc2ccc(CN)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-3-16(2)8-10-19(11-9-16)15(20)18-14-6-4-13(12-17)5-7-14/h4-7H,3,8-12,17H2,1-2H3,(H,18,20)
InChIKeyFNSKQCOLWSXLKG-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.19
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide

N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide (PubChem CID 63161794) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide
PubChem CID63161794
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide
SMILESCCC1(C)CCN(C(=O)Nc2ccc(CN)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-3-16(2)8-10-19(11-9-16)15(20)18-14-6-4-13(12-17)5-7-14/h4-7H,3,8-12,17H2,1-2H3,(H,18,20)
InChIKeyFNSKQCOLWSXLKG-UHFFFAOYSA-N
XLogP3.19
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide 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

1-N-[4-(aminomethyl)phenyl]-3-N,3-dimethylpyrrolidine-1,3-dicarboxamide
CID 106319264
N-(3-acetylphenyl)-4-ethyl-4-methylpiperidine-1-carboxamide
CID 62734496
N-[4-(aminomethyl)phenyl]-4-methylpiperidine-1-carboxamide
CID 43133019
N-[3-(aminomethyl)phenyl]-4-hydroxy-4-methylpiperidine-1-carboxamide
CID 81116359
N-[4-(aminomethyl)phenyl]-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 43592283
N-[4-(aminomethyl)phenyl]-3,4-dihydroxypyrrolidine-1-carboxamide
CID 106670528
1-N-[4-(aminomethyl)phenyl]-4-N-methylpiperidine-1,4-dicarboxamide
CID 61440098
[3-(aminomethyl)phenyl]-(4-ethyl-4-methylpiperidin-1-yl)methanone
CID 63157358
N-[4-(aminomethyl)phenyl]-3,5-dioxopiperazine-1-carboxamide
CID 66061825
N-[4-[[4-(aminomethyl)benzoyl]amino]phenyl]azepane-1-carboxamide
CID 119310690
4-N-benzyl-1-N-(4-ethylphenyl)-4-methylpiperidine-1,4-dicarboxamide
CID 52998873
2-[4-[(4-ethyl-4-methylpiperidine-1-carbonyl)amino]pyrazol-1-yl]acetic acid
CID 63162069

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide (CID 63161794) is N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide is CCC1(C)CCN(C(=O)Nc2ccc(CN)cc2)CC1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide?
The InChIKey is FNSKQCOLWSXLKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-16(2)8-10-19(11-9-16)15(20)18-14-6-4-13(12-17)5-7-14/h4-7H,3,8-12,17H2,1-2H3,(H,18,20).
What are the key properties of N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide?
N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-4-ethyl-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 63161794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).