N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide

C11H18N2O2 — CID 60948651

IUPACN,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide
SMILESC=CC(=O)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C11H18N2O2/c1-4-10(14)13-7-5-9(6-8-13)11(15)12(2)3/h4,9H,1,5-8H2,2-3H3
InChIKeyWWYOVNIPQRCFAK-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.50
Rot. Bonds2

About N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide

N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide (PubChem CID 60948651) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide
PubChem CID60948651
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide
SMILESC=CC(=O)N1CCC(C(=O)N(C)C)CC1
InChIInChI=1S/C11H18N2O2/c1-4-10(14)13-7-5-9(6-8-13)11(15)12(2)3/h4,9H,1,5-8H2,2-3H3
InChIKeyWWYOVNIPQRCFAK-UHFFFAOYSA-N
XLogP0.50
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-4-prop-2-enoylpiperazine-1-carboxamide
CID 60949594
1-pyrrolidin-1-ylprop-2-en-1-one;N,N,2-trimethylprop-2-enamide
CID 70414233
1-(2-hydroxyacetyl)-N,N-dimethylpiperidine-4-carboxamide
CID 170068801
1-acetyl-N,N-dimethylpyrrolidine-3-carboxamide
CID 130660566
1-(4-tert-butylpiperidin-1-yl)prop-2-en-1-one
CID 62091794
N-methyl-N-(naphthalen-2-ylmethyl)-1-prop-2-enoylpiperidine-4-carboxamide
CID 154832559
1-[3-(2,6-dichlorophenyl)prop-2-enoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 78779450
1-(4-prop-1-ynylpiperidin-1-yl)prop-2-en-1-one
CID 176702191
acetaldehyde;1-pyrrolidin-1-ylprop-2-en-1-one
CID 156736748
N-methyl-N-[(2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-yl)methyl]-1-prop-2-enoylpiperidine-4-carboxamide
CID 166405409
N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide
CID 93370935
1-(4-hydroxybutanoyl)-N,N-dimethylpiperidine-4-carboxamide
CID 79200392

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide?
The IUPAC name of N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide (CID 60948651) is N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide is C=CC(=O)N1CCC(C(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide?
The InChIKey is WWYOVNIPQRCFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-10(14)13-7-5-9(6-8-13)11(15)12(2)3/h4,9H,1,5-8H2,2-3H3.
What are the key properties of N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide?
N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-prop-2-enoylpiperidine-4-carboxamide is sourced from PubChem (CID 60948651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).