N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide

C14H26N2O — CID 114084316

IUPACN-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide
SMILESCC1(C)CCCNC1C(=O)NCCCC1CC1
InChIInChI=1S/C14H26N2O/c1-14(2)8-4-10-15-12(14)13(17)16-9-3-5-11-6-7-11/h11-12,15H,3-10H2,1-2H3,(H,16,17)
InChIKeyAJHZZIDHVIEPHY-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.07
Rot. Bonds5

About N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide

N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide (PubChem CID 114084316) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide
PubChem CID114084316
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide
SMILESCC1(C)CCCNC1C(=O)NCCCC1CC1
InChIInChI=1S/C14H26N2O/c1-14(2)8-4-10-15-12(14)13(17)16-9-3-5-11-6-7-11/h11-12,15H,3-10H2,1-2H3,(H,16,17)
InChIKeyAJHZZIDHVIEPHY-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-5-oxopentyl)-3,3-dimethylpiperidine-2-carboxamide
CID 114162096
3,3-dimethyl-N-pent-4-ynylpiperidine-2-carboxamide
CID 106221816
3,3-dimethyl-N-(3-methylsulfanylbutyl)piperidine-2-carboxamide
CID 114084303
3,3-dimethyl-N-[2-(2-methylpropoxy)ethyl]piperidine-2-carboxamide
CID 114084318
N-[(1-methoxycyclobutyl)methyl]-3,3-dimethylpiperidine-2-carboxamide
CID 114119268
N-(4-aminocyclohexyl)-3,3-dimethylpiperidine-2-carboxamide
CID 114084152
(2S)-3,3-dimethylpiperidine-2-carboxylic acid
CID 93492996
3,3-dimethyl-N-(2-methylcyclohexyl)piperidine-2-carboxamide
CID 114083995
N-(3-cyclopropylpropyl)-3-methylpyrrolidine-3-carboxamide
CID 115740541
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-3,3-dimethylpiperidine-2-carboxamide
CID 114084217
3,3-dimethyl-N-[(1-methylpyrrol-3-yl)methyl]piperidine-2-carboxamide
CID 106390878
(2S)-N-butylpyrrolidine-2-carboxamide
CID 22691332

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide?
The IUPAC name of N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide (CID 114084316) is N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide?
The canonical SMILES for N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide is CC1(C)CCCNC1C(=O)NCCCC1CC1.
What is the InChIKey of N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide?
The InChIKey is AJHZZIDHVIEPHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-14(2)8-4-10-15-12(14)13(17)16-9-3-5-11-6-7-11/h11-12,15H,3-10H2,1-2H3,(H,16,17).
What are the key properties of N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide?
N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropylpropyl)-3,3-dimethylpiperidine-2-carboxamide is sourced from PubChem (CID 114084316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).