N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide

C16H28N4O — CID 110203837

IUPACN,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide
SMILESCc1cnc(CC2CCCN(C(=O)N(C)C)C2)n1C(C)C
InChIInChI=1S/C16H28N4O/c1-12(2)20-13(3)10-17-15(20)9-14-7-6-8-19(11-14)16(21)18(4)5/h10,12,14H,6-9,11H2,1-5H3
InChIKeyYUCZBSHTJZVRLG-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.71
Rot. Bonds3

About N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide

N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide (PubChem CID 110203837) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide
PubChem CID110203837
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC NameN,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide
SMILESCc1cnc(CC2CCCN(C(=O)N(C)C)C2)n1C(C)C
InChIInChI=1S/C16H28N4O/c1-12(2)20-13(3)10-17-15(20)9-14-7-6-8-19(11-14)16(21)18(4)5/h10,12,14H,6-9,11H2,1-5H3
InChIKeyYUCZBSHTJZVRLG-UHFFFAOYSA-N
XLogP2.71
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide (CID 110203837) is N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide is Cc1cnc(CC2CCCN(C(=O)N(C)C)C2)n1C(C)C.
What is the InChIKey of N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide?
The InChIKey is YUCZBSHTJZVRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-12(2)20-13(3)10-17-15(20)9-14-7-6-8-19(11-14)16(21)18(4)5/h10,12,14H,6-9,11H2,1-5H3.
What are the key properties of N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide?
N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide has a molecular weight of 292.43 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(5-methyl-1-propan-2-ylimidazol-2-yl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 110203837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).