N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide

C15H28N2O2 — CID 114428069

IUPACN-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCCOCC2CC2)C1
InChIInChI=1S/C15H28N2O2/c1-2-12-6-8-16-14(10-12)15(18)17-7-3-9-19-11-13-4-5-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyUTTMNLOTWJDGGK-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds8

About N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide

N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide (PubChem CID 114428069) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
PubChem CID114428069
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCCOCC2CC2)C1
InChIInChI=1S/C15H28N2O2/c1-2-12-6-8-16-14(10-12)15(18)17-7-3-9-19-11-13-4-5-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyUTTMNLOTWJDGGK-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954
7-[(4-ethylpiperidine-2-carbonyl)amino]heptanoic acid
CID 114428646
4-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidine-2-carboxamide
CID 114429060
N-(2-cyclopentyloxyethyl)-4-ethylpiperidine-2-carboxamide
CID 114429058
(2S,4S)-N-[3-(cyclopropylmethoxy)propyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120618698
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 114428936
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
4-ethyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 114428071
4-methyl-N-[3-(oxolan-2-ylmethoxy)propyl]piperidine-2-carboxamide
CID 114423702
4-ethyl-N-[(3-hydroxycyclopentyl)methyl]piperidine-2-carboxamide
CID 114148003
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide (CID 114428069) is N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)NCCCOCC2CC2)C1.
What is the InChIKey of N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide?
The InChIKey is UTTMNLOTWJDGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-2-12-6-8-16-14(10-12)15(18)17-7-3-9-19-11-13-4-5-13/h12-14,16H,2-11H2,1H3,(H,17,18).
What are the key properties of N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide?
N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114428069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).