N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide

C14H27N3O2 — CID 119442340

IUPACN'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide
SMILESCC(C)NC(=O)CCCC(=O)N(C)C1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-11(2)16-13(18)5-4-6-14(19)17(3)12-7-9-15-10-8-12/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKeyTYKVUJMIUQDEGR-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.89
Rot. Bonds6

About N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide

N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide (PubChem CID 119442340) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide.

Molecular Properties

Compound NameN'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide
PubChem CID119442340
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide
SMILESCC(C)NC(=O)CCCC(=O)N(C)C1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-11(2)16-13(18)5-4-6-14(19)17(3)12-7-9-15-10-8-12/h11-12,15H,4-10H2,1-3H3,(H,16,18)
InChIKeyTYKVUJMIUQDEGR-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide 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

(S)-N-(2,6-Dioxopiperidin-3-yl)pentanamide
CID 10965828
2,5-Diamino-1-piperidin-1-yl-pentan-1-one
CID 10081481
N-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butyl)-acetamide
CID 10353699
N,N'-di(propan-2-yl)pentanediamide
CID 2164757
N-(1-acetylpiperidin-3-yl)propanamide
CID 44454221
1-Acetyl-4-(methylamino)piperidine
CID 19761265
2-cyano-N-(1-propylpiperidin-4-yl)acetamide
CID 1247562
Propanamide, N-4-piperidinyl-
CID 1445175
Cyclo(-ala-gln)
CID 9209568
2-Amino-1-piperidin-1-yl-pentan-1-one
CID 43650152
N-(1-propanoylpiperidin-4-yl)acetamide
CID 46228315
N-(1-acetylpiperidin-4-yl)propanamide
CID 46228316

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide?
The IUPAC name of N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide (CID 119442340) is N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide.
What is the SMILES notation for N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide?
The canonical SMILES for N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide is CC(C)NC(=O)CCCC(=O)N(C)C1CCNCC1.
What is the InChIKey of N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide?
The InChIKey is TYKVUJMIUQDEGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-11(2)16-13(18)5-4-6-14(19)17(3)12-7-9-15-10-8-12/h11-12,15H,4-10H2,1-3H3,(H,16,18).
What are the key properties of N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide?
N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide has a molecular weight of 269.39 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-piperidin-4-yl-N-propan-2-ylpentanediamide is sourced from PubChem (CID 119442340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).