2-butyl-N-methylcyclopropan-1-amine;propan-1-ol

C11H25NO — CID 89249229

IUPAC2-butyl-N-methylcyclopropan-1-amine;propan-1-ol
SMILESCCCCC1CC1NC.CCCO
InChIInChI=1S/C8H17N.C3H8O/c1-3-4-5-7-6-8(7)9-2;1-2-3-4/h7-9H,3-6H2,1-2H3;4H,2-3H2,1H3
InChIKeyFUFXWYPWLDFACT-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.17
Rot. Bonds5

About 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol

2-butyl-N-methylcyclopropan-1-amine;propan-1-ol (PubChem CID 89249229) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol.

Molecular Properties

Compound Name2-butyl-N-methylcyclopropan-1-amine;propan-1-ol
PubChem CID89249229
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2-butyl-N-methylcyclopropan-1-amine;propan-1-ol
SMILESCCCCC1CC1NC.CCCO
InChIInChI=1S/C8H17N.C3H8O/c1-3-4-5-7-6-8(7)9-2;1-2-3-4/h7-9H,3-6H2,1-2H3;4H,2-3H2,1H3
InChIKeyFUFXWYPWLDFACT-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol?
The IUPAC name of 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol (CID 89249229) is 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol.
What is the SMILES notation for 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol?
The canonical SMILES for 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol is CCCCC1CC1NC.CCCO.
What is the InChIKey of 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol?
The InChIKey is FUFXWYPWLDFACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C3H8O/c1-3-4-5-7-6-8(7)9-2;1-2-3-4/h7-9H,3-6H2,1-2H3;4H,2-3H2,1H3.
What are the key properties of 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol?
2-butyl-N-methylcyclopropan-1-amine;propan-1-ol has a molecular weight of 187.33 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-N-methylcyclopropan-1-amine;propan-1-ol is sourced from PubChem (CID 89249229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).