[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine

C10H19N3 — CID 105439692

IUPAC[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine
SMILESCC(C)c1nc(CN)[nH]c1C(C)C
InChIInChI=1S/C10H19N3/c1-6(2)9-10(7(3)4)13-8(5-11)12-9/h6-7H,5,11H2,1-4H3,(H,12,13)
InChIKeyCDZXCWCIDIPOPY-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.12
Rot. Bonds3

About [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine

[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine (PubChem CID 105439692) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine
PubChem CID105439692
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine
SMILESCC(C)c1nc(CN)[nH]c1C(C)C
InChIInChI=1S/C10H19N3/c1-6(2)9-10(7(3)4)13-8(5-11)12-9/h6-7H,5,11H2,1-4H3,(H,12,13)
InChIKeyCDZXCWCIDIPOPY-UHFFFAOYSA-N
XLogP2.12
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 ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4-tert-butyl-5-propan-2-yl-1H-imidazol-2-yl)methanamine
CID 105449546
2-(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)ethanamine
CID 82236116
chlorozinc(1+);tris[4,5-di(propan-2-yl)-1H-imidazol-2-yl]phosphane
CID 5248663
2-(aminomethyl)-6-propan-2-yl-1H-1,3,5-triazine-4-thione;aziridine
CID 174265337
(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
CID 105430142
N-[(5-methyl-4-propan-2-yl-1H-imidazol-2-yl)methyl]ethanamine
CID 114997302
(5-ethyl-4-propan-2-yl-1H-imidazol-2-yl)methanol
CID 105433907
5-methyl-4-propan-2-yl-2-propyl-1H-pyrimidin-6-one
CID 136692836
2,5-di(pentan-2-yl)-4-propan-2-yl-1H-imidazole
CID 66723389
(2-cyclohexyl-4-propan-2-yl-1H-imidazol-5-yl)methanamine
CID 82373843
4-(2-aminoethyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one
CID 84731798
5-bromo-2-(methoxymethyl)-6-propan-2-yl-1H-pyrimidine-4-thione
CID 106480222

Frequently Asked Questions

What is the IUPAC name of [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine?
The IUPAC name of [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine (CID 105439692) is [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine.
What is the SMILES notation for [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine?
The canonical SMILES for [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine is CC(C)c1nc(CN)[nH]c1C(C)C.
What is the InChIKey of [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine?
The InChIKey is CDZXCWCIDIPOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-6(2)9-10(7(3)4)13-8(5-11)12-9/h6-7H,5,11H2,1-4H3,(H,12,13).
What are the key properties of [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine?
[4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine has a molecular weight of 181.28 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4,5-di(propan-2-yl)-1H-imidazol-2-yl]methanamine is sourced from PubChem (CID 105439692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).