(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol

C7H15NO — CID 129371678

IUPAC(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol
SMILESCNCC[C@H](O)C1CC1
InChIInChI=1S/C7H15NO/c1-8-5-4-7(9)6-2-3-6/h6-9H,2-5H2,1H3/t7-/m0/s1
InChIKeyNATIXTVGBXIWGU-ZETCQYMHSA-N
MW129.20 g/mol
LogP0.37
Rot. Bonds4

About (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol

(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol (PubChem CID 129371678) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol.

Molecular Properties

Compound Name(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol
PubChem CID129371678
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol
SMILESCNCC[C@H](O)C1CC1
InChIInChI=1S/C7H15NO/c1-8-5-4-7(9)6-2-3-6/h6-9H,2-5H2,1H3/t7-/m0/s1
InChIKeyNATIXTVGBXIWGU-ZETCQYMHSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 167001282
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CID 62606898
N-(2-cyclopropyl-2-hydroxyethyl)-3-(methylamino)propanamide
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CID 83158070
1-cyclopropylheptan-1-ol
CID 10909821
1-cyclopropyltetradecan-1-ol
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1-cyclopropyltridecan-1-ol
CID 63410999
3-N-(1-cyclopropylethyl)-1-N,3-N-dimethylbutane-1,3-diamine
CID 62433399
(1R)-3-(methylamino)-1-[(2S,4R)-4-propan-2-ylpyrrolidin-2-yl]propan-1-ol
CID 89432897
4-(methylamino)butan-2-ol;hydrochloride
CID 135392389
1-(4-propan-2-ylcycloheptyl)butan-1-ol
CID 83050929

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol?
The IUPAC name of (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol (CID 129371678) is (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol.
What is the SMILES notation for (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol?
The canonical SMILES for (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol is CNCC[C@H](O)C1CC1.
What is the InChIKey of (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol?
The InChIKey is NATIXTVGBXIWGU-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H15NO/c1-8-5-4-7(9)6-2-3-6/h6-9H,2-5H2,1H3/t7-/m0/s1.
What are the key properties of (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol?
(1S)-1-cyclopropyl-3-(methylamino)propan-1-ol has a molecular weight of 129.20 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopropyl-3-(methylamino)propan-1-ol is sourced from PubChem (CID 129371678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).