N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide

C14H27N3O2 — CID 106276461

IUPACN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCC(C)(C)C(N)=O)CCNCC1
InChIInChI=1S/C14H27N3O2/c1-4-5-14(6-8-16-9-7-14)12(19)17-10-13(2,3)11(15)18/h16H,4-10H2,1-3H3,(H2,15,18)(H,17,19)
InChIKeyNALGHQPJSKAWHS-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.78
Rot. Bonds6

About N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide

N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide (PubChem CID 106276461) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide
PubChem CID106276461
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCC(C)(C)C(N)=O)CCNCC1
InChIInChI=1S/C14H27N3O2/c1-4-5-14(6-8-16-9-7-14)12(19)17-10-13(2,3)11(15)18/h16H,4-10H2,1-3H3,(H2,15,18)(H,17,19)
InChIKeyNALGHQPJSKAWHS-UHFFFAOYSA-N
XLogP0.78
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-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

N-(cyanomethyl)-4-propylpiperidine-4-carboxamide
CID 63129150
N-(2-aminoethyl)-4-propylpiperidine-4-carboxamide
CID 63128598
N-(2-methylbutyl)-4-propylpiperidine-4-carboxamide
CID 63129494
N-[2-oxo-2-(propylamino)ethyl]-4-propylpiperidine-4-carboxamide
CID 63127591
N-(2-methylsulfonylethyl)-4-propylpiperidine-4-carboxamide
CID 55177593
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-propylpiperidine-4-carboxamide
CID 83112493
N-[2-[ethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
CID 55176449
N-[(4-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127194
3-methyl-4-[(4-propylpiperidine-4-carbonyl)amino]butanoic acid
CID 81073203
N-(1-hydroxypropan-2-yl)-4-propylpiperidine-4-carboxamide
CID 63127682
N-[2-(dimethylamino)-3-methylbutyl]-4-propylpiperidine-4-carboxamide
CID 63128641
3-propyl-N-(2,3,3-trimethylbutyl)pyrrolidine-3-carboxamide
CID 83142761

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide (CID 106276461) is N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NCC(C)(C)C(N)=O)CCNCC1.
What is the InChIKey of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide?
The InChIKey is NALGHQPJSKAWHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-4-5-14(6-8-16-9-7-14)12(19)17-10-13(2,3)11(15)18/h16H,4-10H2,1-3H3,(H2,15,18)(H,17,19).
What are the key properties of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide?
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.78, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 106276461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).