1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde

C10H16O — CID 131142598

IUPAC1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde
SMILESO=CC1(CC2CC2)CCCC1
InChIInChI=1S/C10H16O/c11-8-10(5-1-2-6-10)7-9-3-4-9/h8-9H,1-7H2
InChIKeyLQLZRGJWHLBHOS-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.55
Rot. Bonds3

About 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde

1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde (PubChem CID 131142598) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde
PubChem CID131142598
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde
SMILESO=CC1(CC2CC2)CCCC1
InChIInChI=1S/C10H16O/c11-8-10(5-1-2-6-10)7-9-3-4-9/h8-9H,1-7H2
InChIKeyLQLZRGJWHLBHOS-UHFFFAOYSA-N
XLogP2.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde?
The IUPAC name of 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde (CID 131142598) is 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde.
What is the SMILES notation for 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde?
The canonical SMILES for 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde is O=CC1(CC2CC2)CCCC1.
What is the InChIKey of 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde?
The InChIKey is LQLZRGJWHLBHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c11-8-10(5-1-2-6-10)7-9-3-4-9/h8-9H,1-7H2.
What are the key properties of 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde?
1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde has a molecular weight of 152.24 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)cyclopentane-1-carbaldehyde is sourced from PubChem (CID 131142598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).