4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide

C18H25N5O — CID 155871375

IUPAC4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide
SMILESCc1cccnc1CN1CCC(C(=O)N(C)C)(n2ccnc2)CC1
InChIInChI=1S/C18H25N5O/c1-15-5-4-8-20-16(15)13-22-10-6-18(7-11-22,17(24)21(2)3)23-12-9-19-14-23/h4-5,8-9,12,14H,6-7,10-11,13H2,1-3H3
InChIKeyISKDFVAJWJGOEQ-UHFFFAOYSA-N
MW327.43 g/mol
LogP1.67
Rot. Bonds4

About 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide

4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide (PubChem CID 155871375) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide
PubChem CID155871375
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide
SMILESCc1cccnc1CN1CCC(C(=O)N(C)C)(n2ccnc2)CC1
InChIInChI=1S/C18H25N5O/c1-15-5-4-8-20-16(15)13-22-10-6-18(7-11-22,17(24)21(2)3)23-12-9-19-14-23/h4-5,8-9,12,14H,6-7,10-11,13H2,1-3H3
InChIKeyISKDFVAJWJGOEQ-UHFFFAOYSA-N
XLogP1.67
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155874103
1-[(2-chlorophenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide;formic acid
CID 171695756
1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155877437
1-(2-ethylbutyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155872498
4-imidazol-1-yl-N,N-dimethyl-1-propylsulfonylpiperidine-4-carboxamide
CID 155876535
1-(4-fluorophenyl)sulfonyl-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155874322
[4-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 107160723
8-[(3-methyl-2-pyridinyl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
CID 112550214
1-[(2-ethoxyphenyl)methyl]-4-imidazol-1-ylpiperidine-4-carboxylic acid
CID 56889081
4-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboximidamide
CID 107162142
2-[4-[(3-methyl-2-pyridinyl)methyl]piperazin-1-yl]ethanol
CID 112550205
cyclopropyl-[4-[(3-methyl-2-pyridinyl)methyl]piperazin-1-yl]methanone
CID 171326322

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide (CID 155871375) is 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide is Cc1cccnc1CN1CCC(C(=O)N(C)C)(n2ccnc2)CC1.
What is the InChIKey of 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide?
The InChIKey is ISKDFVAJWJGOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-15-5-4-8-20-16(15)13-22-10-6-18(7-11-22,17(24)21(2)3)23-12-9-19-14-23/h4-5,8-9,12,14H,6-7,10-11,13H2,1-3H3.
What are the key properties of 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide?
4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 1.67, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 155871375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).