[1-(1-aminoethyl)cyclopropyl]methanol

C6H13NO — CID 116943169

IUPAC[1-(1-aminoethyl)cyclopropyl]methanol
SMILESCC(N)C1(CO)CC1
InChIInChI=1S/C6H13NO/c1-5(7)6(4-8)2-3-6/h5,8H,2-4,7H2,1H3
InChIKeyIFKKEBDJRLRCKH-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.11
Rot. Bonds2

About [1-(1-aminoethyl)cyclopropyl]methanol

[1-(1-aminoethyl)cyclopropyl]methanol (PubChem CID 116943169) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is [1-(1-aminoethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(1-aminoethyl)cyclopropyl]methanol
PubChem CID116943169
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name[1-(1-aminoethyl)cyclopropyl]methanol
SMILESCC(N)C1(CO)CC1
InChIInChI=1S/C6H13NO/c1-5(7)6(4-8)2-3-6/h5,8H,2-4,7H2,1H3
InChIKeyIFKKEBDJRLRCKH-UHFFFAOYSA-N
XLogP0.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(1-aminoethyl)cyclopropyl]methanol?
The IUPAC name of [1-(1-aminoethyl)cyclopropyl]methanol (CID 116943169) is [1-(1-aminoethyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(1-aminoethyl)cyclopropyl]methanol?
The canonical SMILES for [1-(1-aminoethyl)cyclopropyl]methanol is CC(N)C1(CO)CC1.
What is the InChIKey of [1-(1-aminoethyl)cyclopropyl]methanol?
The InChIKey is IFKKEBDJRLRCKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-5(7)6(4-8)2-3-6/h5,8H,2-4,7H2,1H3.
What are the key properties of [1-(1-aminoethyl)cyclopropyl]methanol?
[1-(1-aminoethyl)cyclopropyl]methanol has a molecular weight of 115.18 g/mol, XLogP of 0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-aminoethyl)cyclopropyl]methanol is sourced from PubChem (CID 116943169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).