N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole

C10H21N3 — CID 144593891

IUPACN,N-dimethylbutan-1-amine;5-methyl-1H-imidazole
SMILESCCCCN(C)C.Cc1cnc[nH]1
InChIInChI=1S/C6H15N.C4H6N2/c1-4-5-6-7(2)3;1-4-2-5-3-6-4/h4-6H2,1-3H3;2-3H,1H3,(H,5,6)
InChIKeyKTJFCVNWEQMXLJ-UHFFFAOYSA-N
MW183.30 g/mol
LogP2.07
Rot. Bonds3

About N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole

N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole (PubChem CID 144593891) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole.

Molecular Properties

Compound NameN,N-dimethylbutan-1-amine;5-methyl-1H-imidazole
PubChem CID144593891
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN,N-dimethylbutan-1-amine;5-methyl-1H-imidazole
SMILESCCCCN(C)C.Cc1cnc[nH]1
InChIInChI=1S/C6H15N.C4H6N2/c1-4-5-6-7(2)3;1-4-2-5-3-6-4/h4-6H2,1-3H3;2-3H,1H3,(H,5,6)
InChIKeyKTJFCVNWEQMXLJ-UHFFFAOYSA-N
XLogP2.07
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole?
The IUPAC name of N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole (CID 144593891) is N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole.
What is the SMILES notation for N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole?
The canonical SMILES for N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole is CCCCN(C)C.Cc1cnc[nH]1.
What is the InChIKey of N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole?
The InChIKey is KTJFCVNWEQMXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C4H6N2/c1-4-5-6-7(2)3;1-4-2-5-3-6-4/h4-6H2,1-3H3;2-3H,1H3,(H,5,6).
What are the key properties of N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole?
N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole has a molecular weight of 183.30 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylbutan-1-amine;5-methyl-1H-imidazole is sourced from PubChem (CID 144593891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).