N-(1-phenylpropyl)oxolane-2-carboxamide

C14H19NO2 — CID 6467126

IUPACN-(1-phenylpropyl)oxolane-2-carboxamide
SMILESCCC(NC(=O)C1CCCO1)c1ccccc1
InChIInChI=1S/C14H19NO2/c1-2-12(11-7-4-3-5-8-11)15-14(16)13-9-6-10-17-13/h3-5,7-8,12-13H,2,6,9-10H2,1H3,(H,15,16)
InChIKeyIUMMHAKYCBGADK-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.43
Rot. Bonds4

About N-(1-phenylpropyl)oxolane-2-carboxamide

N-(1-phenylpropyl)oxolane-2-carboxamide (PubChem CID 6467126) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(1-phenylpropyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(1-phenylpropyl)oxolane-2-carboxamide
PubChem CID6467126
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(1-phenylpropyl)oxolane-2-carboxamide
SMILESCCC(NC(=O)C1CCCO1)c1ccccc1
InChIInChI=1S/C14H19NO2/c1-2-12(11-7-4-3-5-8-11)15-14(16)13-9-6-10-17-13/h3-5,7-8,12-13H,2,6,9-10H2,1H3,(H,15,16)
InChIKeyIUMMHAKYCBGADK-UHFFFAOYSA-N
XLogP2.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]tetrahydrofuran-2-carboxamide
CID 2970803
Benzamide, N-tetrahydrofurfuryl-3-methyl-
CID 531960
Acetamide, N-tetrahydrofurfuryl-2-phenyl-
CID 531986
N-(4-chlorobenzyl)tetrahydro-2-furancarboxamide
CID 2932408
N-(2-chlorobenzyl)tetrahydro-2-furancarboxamide
CID 2957283
N-(2-bromobenzyl)tetrahydrofuran-2-carboxamide
CID 2971017
N-[(3-chlorophenyl)methyl]oxolane-2-carboxamide
CID 2971265
[2-Oxo-2-(1-phenylethylamino)ethyl] cyclohexanecarboxylate
CID 4395063
(4-Benzhydrylpiperazin-1-yl)-(oxolan-2-yl)methanone
CID 3860526
2-(4-fluorophenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 3148058
N-(4-Methyl-benzyl)-N'-(tetrahydro-furan-2-ylmethyl)-oxalamide
CID 2891290
3-phenyl-N-(tetrahydro-2-furanylmethyl)butanamide
CID 2914304

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropyl)oxolane-2-carboxamide?
The IUPAC name of N-(1-phenylpropyl)oxolane-2-carboxamide (CID 6467126) is N-(1-phenylpropyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(1-phenylpropyl)oxolane-2-carboxamide?
The canonical SMILES for N-(1-phenylpropyl)oxolane-2-carboxamide is CCC(NC(=O)C1CCCO1)c1ccccc1.
What is the InChIKey of N-(1-phenylpropyl)oxolane-2-carboxamide?
The InChIKey is IUMMHAKYCBGADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-12(11-7-4-3-5-8-11)15-14(16)13-9-6-10-17-13/h3-5,7-8,12-13H,2,6,9-10H2,1H3,(H,15,16).
What are the key properties of N-(1-phenylpropyl)oxolane-2-carboxamide?
N-(1-phenylpropyl)oxolane-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropyl)oxolane-2-carboxamide is sourced from PubChem (CID 6467126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).