N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide

C12H25N3O — CID 70672359

IUPACN-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide
SMILESCCN1CCC(C(=O)NCCN(C)C)CC1
InChIInChI=1S/C12H25N3O/c1-4-15-8-5-11(6-9-15)12(16)13-7-10-14(2)3/h11H,4-10H2,1-3H3,(H,13,16)
InChIKeyMKTONDPTLOWRPS-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.40
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide

N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide (PubChem CID 70672359) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide
PubChem CID70672359
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide
SMILESCCN1CCC(C(=O)NCCN(C)C)CC1
InChIInChI=1S/C12H25N3O/c1-4-15-8-5-11(6-9-15)12(16)13-7-10-14(2)3/h11H,4-10H2,1-3H3,(H,13,16)
InChIKeyMKTONDPTLOWRPS-UHFFFAOYSA-N
XLogP0.40
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Enmd-1068
CID 9950925
N,N-dimethylpiperidine-4-carboxamide hydrochloride
CID 19872414
N,N-Diethyl-4-piperidinecarboxamide
CID 410920
N,N-dimethylpiperidine-4-carboxamide
CID 411689
1-Ethylpiperidine-4-carboxamide
CID 567825
N-[3-(dimethylamino)propyl]piperidine-4-carboxamide
CID 2186960
3-(2-Butanyl)-6-methyl-2,5-piperazinedione
CID 45359405
Valeramide, N-(2-(dimethylamino)ethyl)-2-propyl-
CID 200807
(3S,6S)-3-((2S)-butan-2-yl)-6-methylpiperazine-2,5-dione
CID 71359704
1-(2-(4-Piperidinyl)ethyl)-2-pyrrolidinone
CID 4712456
2-ethyl-N-[2-(2-ethylbutanoylamino)ethyl]butanamide
CID 228244
1-(Piperidin-4-ylcarbonyl)piperidine
CID 2794688

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide (CID 70672359) is N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide is CCN1CCC(C(=O)NCCN(C)C)CC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide?
The InChIKey is MKTONDPTLOWRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-15-8-5-11(6-9-15)12(16)13-7-10-14(2)3/h11H,4-10H2,1-3H3,(H,13,16).
What are the key properties of N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide?
N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide has a molecular weight of 227.35 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-1-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 70672359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).