N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide

C20H28N2O3 — CID 56869733

IUPACN-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide
SMILESCC(C)Oc1cccc(C(=O)C2CCCN(CC(=O)NC3CC3)C2)c1
InChIInChI=1S/C20H28N2O3/c1-14(2)25-18-7-3-5-15(11-18)20(24)16-6-4-10-22(12-16)13-19(23)21-17-8-9-17/h3,5,7,11,14,16-17H,4,6,8-10,12-13H2,1-2H3,(H,21,23)
InChIKeyIVZRSSCAZIURFB-UHFFFAOYSA-N
MW344.45 g/mol
LogP2.65
Rot. Bonds7

About N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide

N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide (PubChem CID 56869733) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide
PubChem CID56869733
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC NameN-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide
SMILESCC(C)Oc1cccc(C(=O)C2CCCN(CC(=O)NC3CC3)C2)c1
InChIInChI=1S/C20H28N2O3/c1-14(2)25-18-7-3-5-15(11-18)20(24)16-6-4-10-22(12-16)13-19(23)21-17-8-9-17/h3,5,7,11,14,16-17H,4,6,8-10,12-13H2,1-2H3,(H,21,23)
InChIKeyIVZRSSCAZIURFB-UHFFFAOYSA-N
XLogP2.65
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[3-(6-methoxynaphthalene-2-carbonyl)piperidin-1-yl]acetamide
CID 56919001
[1-[(4-hydroxyphenyl)methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 45244750
(1-methylpiperidin-3-yl)-(3-propan-2-yloxyphenyl)methanone
CID 45245966
(3-propan-2-yloxyphenyl)-[1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methanone
CID 45172268
(3S)-N-ethyl-3-(3-propan-2-yloxybenzoyl)piperidine-1-carboxamide
CID 26406225
N-ethyl-3-(3-propan-2-yloxybenzoyl)piperidine-1-carboxamide
CID 45250289
[1-[(1-ethylimidazol-2-yl)methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 45195158
(3-propan-2-yloxyphenyl)-[1-[(3-propan-2-yl-1H-pyrazol-5-yl)methyl]piperidin-3-yl]methanone
CID 45197086
[(3S)-1-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 25395452
[1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 45220380
[1-(2,1,3-benzoxadiazol-4-ylmethyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 45211325
[1-(1,4-dithiepan-6-yl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
CID 45198049

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide (CID 56869733) is N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide is CC(C)Oc1cccc(C(=O)C2CCCN(CC(=O)NC3CC3)C2)c1.
What is the InChIKey of N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide?
The InChIKey is IVZRSSCAZIURFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-14(2)25-18-7-3-5-15(11-18)20(24)16-6-4-10-22(12-16)13-19(23)21-17-8-9-17/h3,5,7,11,14,16-17H,4,6,8-10,12-13H2,1-2H3,(H,21,23).
What are the key properties of N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide?
N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide has a molecular weight of 344.45 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-(3-propan-2-yloxybenzoyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 56869733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).