N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide

C17H35N3O — CID 114428728

IUPACN-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(C(CC)CC)N(C)C)C1
InChIInChI=1S/C17H35N3O/c1-6-13-9-10-18-15(11-13)17(21)19-12-16(20(4)5)14(7-2)8-3/h13-16,18H,6-12H2,1-5H3,(H,19,21)
InChIKeySCPJXBZTRMYMCA-UHFFFAOYSA-N
MW297.49 g/mol
LogP2.25
Rot. Bonds8

About N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide

N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide (PubChem CID 114428728) has the molecular formula C17H35N3O and a molecular weight of 297.49 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide
PubChem CID114428728
Molecular FormulaC17H35N3O
Molecular Weight297.49 g/mol
Exact Mass297.28
IUPAC NameN-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCC(C(CC)CC)N(C)C)C1
InChIInChI=1S/C17H35N3O/c1-6-13-9-10-18-15(11-13)17(21)19-12-16(20(4)5)14(7-2)8-3/h13-16,18H,6-12H2,1-5H3,(H,19,21)
InChIKeySCPJXBZTRMYMCA-UHFFFAOYSA-N
XLogP2.25
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.49
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-(3-ethyl-2-hydroxypentyl)piperidine-2-carboxamide
CID 106286595
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 114428936
N-(cyclohexylmethyl)-4-ethylpiperidine-2-carboxamide
CID 114428046
N-[2-(dimethylamino)-3-ethylpentyl]piperidine-4-carboxamide
CID 61275439
4-ethyl-N-(3-methyl-2-pyrrolidin-1-ylbutyl)piperidine-2-carboxamide
CID 114428726
4-ethyl-N-[(3-hydroxycyclopentyl)methyl]piperidine-2-carboxamide
CID 114148003
N-[3-(cyclopropylmethoxy)propyl]-4-ethylpiperidine-2-carboxamide
CID 114428069
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
CID 114428064
4-ethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 114428843
4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide (CID 114428728) is N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)NCC(C(CC)CC)N(C)C)C1.
What is the InChIKey of N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide?
The InChIKey is SCPJXBZTRMYMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O/c1-6-13-9-10-18-15(11-13)17(21)19-12-16(20(4)5)14(7-2)8-3/h13-16,18H,6-12H2,1-5H3,(H,19,21).
What are the key properties of N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide?
N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide has a molecular weight of 297.49 g/mol, XLogP of 2.25, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-ethylpentyl]-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114428728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).