1-amino-2-cyclopropyl-6-methylheptan-2-ol

C11H23NO — CID 83158527

IUPAC1-amino-2-cyclopropyl-6-methylheptan-2-ol
SMILESCC(C)CCCC(O)(CN)C1CC1
InChIInChI=1S/C11H23NO/c1-9(2)4-3-7-11(13,8-12)10-5-6-10/h9-10,13H,3-8,12H2,1-2H3
InChIKeyUBMUXYJYOASYCF-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.91
Rot. Bonds6

About 1-amino-2-cyclopropyl-6-methylheptan-2-ol

1-amino-2-cyclopropyl-6-methylheptan-2-ol (PubChem CID 83158527) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-amino-2-cyclopropyl-6-methylheptan-2-ol.

Molecular Properties

Compound Name1-amino-2-cyclopropyl-6-methylheptan-2-ol
PubChem CID83158527
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-amino-2-cyclopropyl-6-methylheptan-2-ol
SMILESCC(C)CCCC(O)(CN)C1CC1
InChIInChI=1S/C11H23NO/c1-9(2)4-3-7-11(13,8-12)10-5-6-10/h9-10,13H,3-8,12H2,1-2H3
InChIKeyUBMUXYJYOASYCF-UHFFFAOYSA-N
XLogP1.91
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-2-cyclopropyl-3-[methyl(3-methylbutyl)amino]propan-2-ol
CID 64818466
4-cyclopropyl-2,6-dimethylheptan-4-ol
CID 114865303
(2S)-6-methyl-2-(4-methylcyclohexyl)heptan-2-amine
CID 134132065
1-amino-2-cyclopropyl-3-methoxypropan-2-ol
CID 64813573
1-amino-2-cyclopropyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 64815024
1-amino-3-butylsulfanyl-2-cyclopropylpropan-2-ol
CID 64814258
1-amino-2-cyclopropyl-3-[cyclopropyl(methyl)amino]propan-2-ol
CID 64820350
1-amino-3-cyclobutyloxy-2-cyclopropylpropan-2-ol
CID 64819892
1-amino-3-cyclopentyloxy-2-cyclopropylpropan-2-ol
CID 64812943
4-methylpentylcyclopentane
CID 523530
1-amino-2-cyclopropyl-3-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103181567
1-amino-2-cyclopropyl-3-hexoxypropan-2-ol
CID 64814184

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-cyclopropyl-6-methylheptan-2-ol?
The IUPAC name of 1-amino-2-cyclopropyl-6-methylheptan-2-ol (CID 83158527) is 1-amino-2-cyclopropyl-6-methylheptan-2-ol.
What is the SMILES notation for 1-amino-2-cyclopropyl-6-methylheptan-2-ol?
The canonical SMILES for 1-amino-2-cyclopropyl-6-methylheptan-2-ol is CC(C)CCCC(O)(CN)C1CC1.
What is the InChIKey of 1-amino-2-cyclopropyl-6-methylheptan-2-ol?
The InChIKey is UBMUXYJYOASYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)4-3-7-11(13,8-12)10-5-6-10/h9-10,13H,3-8,12H2,1-2H3.
What are the key properties of 1-amino-2-cyclopropyl-6-methylheptan-2-ol?
1-amino-2-cyclopropyl-6-methylheptan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-cyclopropyl-6-methylheptan-2-ol is sourced from PubChem (CID 83158527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).