N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide

C11H19NO2 — CID 106122134

IUPACN-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide
SMILESO=C(NCC1CCC(O)CC1)C1CC1
InChIInChI=1S/C11H19NO2/c13-10-5-1-8(2-6-10)7-12-11(14)9-3-4-9/h8-10,13H,1-7H2,(H,12,14)
InChIKeyHYSGQUDROXDCSA-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.06
Rot. Bonds3

About N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide

N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide (PubChem CID 106122134) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide
PubChem CID106122134
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide
SMILESO=C(NCC1CCC(O)CC1)C1CC1
InChIInChI=1S/C11H19NO2/c13-10-5-1-8(2-6-10)7-12-11(14)9-3-4-9/h8-10,13H,1-7H2,(H,12,14)
InChIKeyHYSGQUDROXDCSA-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide (CID 106122134) is N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide is O=C(NCC1CCC(O)CC1)C1CC1.
What is the InChIKey of N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide?
The InChIKey is HYSGQUDROXDCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-10-5-1-8(2-6-10)7-12-11(14)9-3-4-9/h8-10,13H,1-7H2,(H,12,14).
What are the key properties of N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide?
N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxycyclohexyl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 106122134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).