N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide

C15H26N4O — CID 72866493

IUPACN-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nccn2C(C)C)CC1
InChIInChI=1S/C15H26N4O/c1-11(2)17-15(20)18-8-5-13(6-9-18)14-16-7-10-19(14)12(3)4/h7,10-13H,5-6,8-9H2,1-4H3,(H,17,20)
InChIKeyXVEZNNMSCNVDAD-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.76
Rot. Bonds3

About N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide

N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide (PubChem CID 72866493) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide
PubChem CID72866493
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nccn2C(C)C)CC1
InChIInChI=1S/C15H26N4O/c1-11(2)17-15(20)18-8-5-13(6-9-18)14-16-7-10-19(14)12(3)4/h7,10-13H,5-6,8-9H2,1-4H3,(H,17,20)
InChIKeyXVEZNNMSCNVDAD-UHFFFAOYSA-N
XLogP2.76
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide (CID 72866493) is N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide is CC(C)NC(=O)N1CCC(c2nccn2C(C)C)CC1.
What is the InChIKey of N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide?
The InChIKey is XVEZNNMSCNVDAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)17-15(20)18-8-5-13(6-9-18)14-16-7-10-19(14)12(3)4/h7,10-13H,5-6,8-9H2,1-4H3,(H,17,20).
What are the key properties of N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide?
N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-4-(1-propan-2-ylimidazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 72866493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).