N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide

C13H24N4O — CID 55114208

IUPACN,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide
SMILESCc1[nH]cnc1CNC(CC(C)C)C(=O)N(C)C
InChIInChI=1S/C13H24N4O/c1-9(2)6-11(13(18)17(4)5)14-7-12-10(3)15-8-16-12/h8-9,11,14H,6-7H2,1-5H3,(H,15,16)
InChIKeyZPCMKZRUVHAKQW-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.31
Rot. Bonds6

About N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide

N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide (PubChem CID 55114208) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide
PubChem CID55114208
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC NameN,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide
SMILESCc1[nH]cnc1CNC(CC(C)C)C(=O)N(C)C
InChIInChI=1S/C13H24N4O/c1-9(2)6-11(13(18)17(4)5)14-7-12-10(3)15-8-16-12/h8-9,11,14H,6-7H2,1-5H3,(H,15,16)
InChIKeyZPCMKZRUVHAKQW-UHFFFAOYSA-N
XLogP1.31
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide?
The IUPAC name of N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide (CID 55114208) is N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide.
What is the SMILES notation for N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide?
The canonical SMILES for N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide is Cc1[nH]cnc1CNC(CC(C)C)C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide?
The InChIKey is ZPCMKZRUVHAKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-9(2)6-11(13(18)17(4)5)14-7-12-10(3)15-8-16-12/h8-9,11,14H,6-7H2,1-5H3,(H,15,16).
What are the key properties of N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide?
N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide has a molecular weight of 252.36 g/mol, XLogP of 1.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-[(5-methyl-1H-imidazol-4-yl)methylamino]pentanamide is sourced from PubChem (CID 55114208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).