(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol

C6H13N3O — CID 141116737

IUPAC(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol
SMILESCN1C=C(CO)N(C)C1N
InChIInChI=1S/C6H13N3O/c1-8-3-5(4-10)9(2)6(8)7/h3,6,10H,4,7H2,1-2H3
InChIKeyFOMCPINRIOVOMY-UHFFFAOYSA-N
MW143.19 g/mol
LogP-1.06
Rot. Bonds1

About (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol

(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol (PubChem CID 141116737) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol.

Molecular Properties

Compound Name(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol
PubChem CID141116737
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol
SMILESCN1C=C(CO)N(C)C1N
InChIInChI=1S/C6H13N3O/c1-8-3-5(4-10)9(2)6(8)7/h3,6,10H,4,7H2,1-2H3
InChIKeyFOMCPINRIOVOMY-UHFFFAOYSA-N
XLogP-1.06
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1-ethyl-2-sulfanyl-1H-imidazol-5-yl)methanol
CID 22988644
5-(Hydroxymethyl)-1-methyl-1,3-dihydro-2H-imidazole-2-thione
CID 2801430
3-ethyl-5-(hydroxymethyl)-1H-imidazole-2-thione
CID 151728307
2,3-dihydro-1H-imidazol-4-ylmethanol
CID 12630193
5-Hydroxymethyl-1-isopropyl-2-mercaptoimidazole
CID 22938592
(2-mercapto-1-propyl-1H-imidazol-5-yl)methanol
CID 22938703
[2-(dimethylamino)-1,3-dimethyl-2H-imidazol-4-yl]methanol
CID 23026367
4-(Hydroxymethyl)-2-mercapto-1-methylimidazole
CID 46839980
(1,2,3-trimethyl-2H-imidazol-4-yl)methanol
CID 67521278
(3-Methyl-2-nitro-1,2-dihydroimidazol-4-yl)methanol
CID 118983485
(3-Ethyl-1,2-dihydroimidazol-4-yl)methanol
CID 126624535
[3-(2-Methylpropyl)-1,2-dihydroimidazol-4-yl]methanol
CID 129095818

Frequently Asked Questions

What is the IUPAC name of (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol?
The IUPAC name of (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol (CID 141116737) is (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol.
What is the SMILES notation for (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol?
The canonical SMILES for (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol is CN1C=C(CO)N(C)C1N.
What is the InChIKey of (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol?
The InChIKey is FOMCPINRIOVOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-8-3-5(4-10)9(2)6(8)7/h3,6,10H,4,7H2,1-2H3.
What are the key properties of (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol?
(2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol has a molecular weight of 143.19 g/mol, XLogP of -1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1,3-dimethyl-2H-imidazol-4-yl)methanol is sourced from PubChem (CID 141116737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).