1-[1-(aminomethyl)cyclopentyl]propan-2-ol

C9H19NO — CID 130514677

IUPAC1-[1-(aminomethyl)cyclopentyl]propan-2-ol
SMILESCC(O)CC1(CN)CCCC1
InChIInChI=1S/C9H19NO/c1-8(11)6-9(7-10)4-2-3-5-9/h8,11H,2-7,10H2,1H3
InChIKeyLHNRMIVDVVGFHE-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.28
Rot. Bonds3

About 1-[1-(aminomethyl)cyclopentyl]propan-2-ol

1-[1-(aminomethyl)cyclopentyl]propan-2-ol (PubChem CID 130514677) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-[1-(aminomethyl)cyclopentyl]propan-2-ol.

Molecular Properties

Compound Name1-[1-(aminomethyl)cyclopentyl]propan-2-ol
PubChem CID130514677
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-[1-(aminomethyl)cyclopentyl]propan-2-ol
SMILESCC(O)CC1(CN)CCCC1
InChIInChI=1S/C9H19NO/c1-8(11)6-9(7-10)4-2-3-5-9/h8,11H,2-7,10H2,1H3
InChIKeyLHNRMIVDVVGFHE-UHFFFAOYSA-N
XLogP1.28
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)cyclopentyl]propan-2-ol?
The IUPAC name of 1-[1-(aminomethyl)cyclopentyl]propan-2-ol (CID 130514677) is 1-[1-(aminomethyl)cyclopentyl]propan-2-ol.
What is the SMILES notation for 1-[1-(aminomethyl)cyclopentyl]propan-2-ol?
The canonical SMILES for 1-[1-(aminomethyl)cyclopentyl]propan-2-ol is CC(O)CC1(CN)CCCC1.
What is the InChIKey of 1-[1-(aminomethyl)cyclopentyl]propan-2-ol?
The InChIKey is LHNRMIVDVVGFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(11)6-9(7-10)4-2-3-5-9/h8,11H,2-7,10H2,1H3.
What are the key properties of 1-[1-(aminomethyl)cyclopentyl]propan-2-ol?
1-[1-(aminomethyl)cyclopentyl]propan-2-ol has a molecular weight of 157.26 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)cyclopentyl]propan-2-ol is sourced from PubChem (CID 130514677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).