2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol

C13H25NO — CID 62609054

IUPAC2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
SMILESCCCN(CC1CC1)CC1CCCC1O
InChIInChI=1S/C13H25NO/c1-2-8-14(9-11-6-7-11)10-12-4-3-5-13(12)15/h11-13,15H,2-10H2,1H3
InChIKeyUIYNNAGUNPOBCZ-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.27
Rot. Bonds6

About 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol

2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol (PubChem CID 62609054) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
PubChem CID62609054
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
SMILESCCCN(CC1CC1)CC1CCCC1O
InChIInChI=1S/C13H25NO/c1-2-8-14(9-11-6-7-11)10-12-4-3-5-13(12)15/h11-13,15H,2-10H2,1H3
InChIKeyUIYNNAGUNPOBCZ-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol (CID 62609054) is 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol is CCCN(CC1CC1)CC1CCCC1O.
What is the InChIKey of 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is UIYNNAGUNPOBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-2-8-14(9-11-6-7-11)10-12-4-3-5-13(12)15/h11-13,15H,2-10H2,1H3.
What are the key properties of 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol?
2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 62609054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).