[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol

C9H19NO — CID 175977285

IUPAC[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol
SMILESCC1C(C)C1(CO)CN(C)C
InChIInChI=1S/C9H19NO/c1-7-8(2)9(7,6-11)5-10(3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyYYQQQTHGMBZBNA-UHFFFAOYSA-N
MW157.26 g/mol
LogP0.81
Rot. Bonds3

About [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol

[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol (PubChem CID 175977285) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol
PubChem CID175977285
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol
SMILESCC1C(C)C1(CO)CN(C)C
InChIInChI=1S/C9H19NO/c1-7-8(2)9(7,6-11)5-10(3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyYYQQQTHGMBZBNA-UHFFFAOYSA-N
XLogP0.81
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol?
The IUPAC name of [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol (CID 175977285) is [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol.
What is the SMILES notation for [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol?
The canonical SMILES for [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol is CC1C(C)C1(CO)CN(C)C.
What is the InChIKey of [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol?
The InChIKey is YYQQQTHGMBZBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-7-8(2)9(7,6-11)5-10(3)4/h7-8,11H,5-6H2,1-4H3.
What are the key properties of [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol?
[1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol has a molecular weight of 157.26 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(dimethylamino)methyl]-2,3-dimethylcyclopropyl]methanol is sourced from PubChem (CID 175977285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).