2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol

C11H17NO2 — CID 115685163

IUPAC2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol
SMILESCC(CO)(NCc1ccoc1)C1CC1
InChIInChI=1S/C11H17NO2/c1-11(8-13,10-2-3-10)12-6-9-4-5-14-7-9/h4-5,7,10,12-13H,2-3,6,8H2,1H3
InChIKeyKATWOXKPTIGELZ-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.53
Rot. Bonds5

About 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol

2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol (PubChem CID 115685163) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol
PubChem CID115685163
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol
SMILESCC(CO)(NCc1ccoc1)C1CC1
InChIInChI=1S/C11H17NO2/c1-11(8-13,10-2-3-10)12-6-9-4-5-14-7-9/h4-5,7,10,12-13H,2-3,6,8H2,1H3
InChIKeyKATWOXKPTIGELZ-UHFFFAOYSA-N
XLogP1.53
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(furan-3-ylmethylamino)-3-methylbutan-1-ol
CID 115655869
N-(furan-3-ylmethyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63424145
2-[(1-tert-butylpyrazol-4-yl)methylamino]-2-cyclopropylpropan-1-ol
CID 111977174
2-cyclopropyl-2-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylamino]propan-1-ol
CID 111977142
2-(furan-3-ylmethylamino)-2-methylpropanoic acid
CID 83171452
(2R)-2-cyclohexyl-2-[(3,5-dimethylphenyl)methylamino]propan-1-ol
CID 99809997
3-(furan-3-ylmethylamino)-3-methylpentan-1-ol
CID 115699077
N-(furan-3-ylmethyl)-2,4,4-trimethylpentan-2-amine
CID 62998644
2-cyclopropyl-2-[(2,2-dimethyl-3H-1-benzofuran-5-yl)methylamino]propan-1-ol
CID 111977137
2-[(3-bromo-4-methoxyphenyl)methylamino]-2-cyclopropylpropan-1-ol
CID 111977072
2-cyclopropyl-2-[(2-fluorophenyl)methylamino]propan-1-ol
CID 111977207
4-tert-butyl-2-(furan-3-ylmethyl)cyclohexan-1-ol
CID 83183283

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol (CID 115685163) is 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol is CC(CO)(NCc1ccoc1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol?
The InChIKey is KATWOXKPTIGELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-11(8-13,10-2-3-10)12-6-9-4-5-14-7-9/h4-5,7,10,12-13H,2-3,6,8H2,1H3.
What are the key properties of 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol?
2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol has a molecular weight of 195.26 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(furan-3-ylmethylamino)propan-1-ol is sourced from PubChem (CID 115685163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).