1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine

C10H19N3 — CID 82236115

IUPAC1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine
SMILESCCC(N)c1nc(C(C)C)c(C)[nH]1
InChIInChI=1S/C10H19N3/c1-5-8(11)10-12-7(4)9(13-10)6(2)3/h6,8H,5,11H2,1-4H3,(H,12,13)
InChIKeyYUCIEEWYFRVEHH-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.25
Rot. Bonds3

About 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine

1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine (PubChem CID 82236115) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine
PubChem CID82236115
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine
SMILESCCC(N)c1nc(C(C)C)c(C)[nH]1
InChIInChI=1S/C10H19N3/c1-5-8(11)10-12-7(4)9(13-10)6(2)3/h6,8H,5,11H2,1-4H3,(H,12,13)
InChIKeyYUCIEEWYFRVEHH-UHFFFAOYSA-N
XLogP2.25
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2,4-di(propan-2-yl)-1H-imidazole
CID 66803864
1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)-2-phenylethanamine
CID 114998039
2-(1-aminopropyl)-4-hydroxy-5-propan-2-yl-1H-pyrimidin-6-one
CID 63554814
(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
CID 105430142
2-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)ethanamine
CID 82236116
N-[(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methyl]ethanamine
CID 114997302
(1R)-1-(4-ethyl-5-methyl-1H-imidazol-2-yl)ethanamine
CID 93255324
1-(5-methyl-2-nonyl-1H-imidazol-4-yl)propan-1-amine
CID 141279115
1-(5-methyl-2-undecyl-1H-imidazol-4-yl)propan-1-amine
CID 141279090
1-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
CID 63722977
1-(6-bromo-4-methyl-1H-benzimidazol-2-yl)propan-1-amine
CID 104574043
1-(2,5-dimethyl-1H-imidazol-4-yl)ethane-1,2-diamine
CID 82416521

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine?
The IUPAC name of 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine (CID 82236115) is 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine.
What is the SMILES notation for 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine?
The canonical SMILES for 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine is CCC(N)c1nc(C(C)C)c(C)[nH]1.
What is the InChIKey of 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine?
The InChIKey is YUCIEEWYFRVEHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-5-8(11)10-12-7(4)9(13-10)6(2)3/h6,8H,5,11H2,1-4H3,(H,12,13).
What are the key properties of 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine?
1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)propan-1-amine is sourced from PubChem (CID 82236115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).