4-cyclopropyl-4-(3-propoxyphenyl)pentanamide

C17H25NO2 — CID 67553858

IUPAC4-cyclopropyl-4-(3-propoxyphenyl)pentanamide
SMILESCCCOc1cccc(C(C)(CCC(N)=O)C2CC2)c1
InChIInChI=1S/C17H25NO2/c1-3-11-20-15-6-4-5-14(12-15)17(2,13-7-8-13)10-9-16(18)19/h4-6,12-13H,3,7-11H2,1-2H3,(H2,18,19)
InChIKeyDSSYGAREFONTRM-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.41
Rot. Bonds8

About 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide

4-cyclopropyl-4-(3-propoxyphenyl)pentanamide (PubChem CID 67553858) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide.

Molecular Properties

Compound Name4-cyclopropyl-4-(3-propoxyphenyl)pentanamide
PubChem CID67553858
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name4-cyclopropyl-4-(3-propoxyphenyl)pentanamide
SMILESCCCOc1cccc(C(C)(CCC(N)=O)C2CC2)c1
InChIInChI=1S/C17H25NO2/c1-3-11-20-15-6-4-5-14(12-15)17(2,13-7-8-13)10-9-16(18)19/h4-6,12-13H,3,7-11H2,1-2H3,(H2,18,19)
InChIKeyDSSYGAREFONTRM-UHFFFAOYSA-N
XLogP3.41
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclopropyl-4-(3-heptoxyphenyl)pentanamide
CID 67553036
4-cyclopropyl-4-(3-prop-2-enoxyphenyl)pentanamide
CID 67554506
N-(1-amino-2-cyclopropylpropan-2-yl)-3-propoxybenzamide
CID 81487028
3-propoxybenzamide
CID 22311435
3-[3-(trifluoromethyl)phenoxy]propanamide
CID 55207241
1-cyclopropyl-1-(3-ethoxyphenyl)ethanol
CID 58452037
2-(3-tert-butylphenoxy)ethyl acetate
CID 20619578
4-(3-ethylphenoxy)butanamide
CID 82040637
(4-methylcyclohexyl)-(3-propoxyphenyl)methanone
CID 114975149
(1-carbamoylcyclopropyl) 8-[3-(2-methyloctan-2-yl)phenoxy]octanoate
CID 91554175
2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide
CID 62337489
1-(3-tert-butylphenoxy)-4-methylpentan-3-one
CID 39351110

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide?
The IUPAC name of 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide (CID 67553858) is 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide.
What is the SMILES notation for 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide?
The canonical SMILES for 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide is CCCOc1cccc(C(C)(CCC(N)=O)C2CC2)c1.
What is the InChIKey of 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide?
The InChIKey is DSSYGAREFONTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-3-11-20-15-6-4-5-14(12-15)17(2,13-7-8-13)10-9-16(18)19/h4-6,12-13H,3,7-11H2,1-2H3,(H2,18,19).
What are the key properties of 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide?
4-cyclopropyl-4-(3-propoxyphenyl)pentanamide has a molecular weight of 275.39 g/mol, XLogP of 3.41, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-4-(3-propoxyphenyl)pentanamide is sourced from PubChem (CID 67553858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).