2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide

C16H26N2O2 — CID 119720978

IUPAC2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide
SMILESCNCC(=O)NC(C)CCc1ccc(OC(C)C)cc1
InChIInChI=1S/C16H26N2O2/c1-12(2)20-15-9-7-14(8-10-15)6-5-13(3)18-16(19)11-17-4/h7-10,12-13,17H,5-6,11H2,1-4H3,(H,18,19)
InChIKeyPIMMXQGYVAUZBT-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.13
Rot. Bonds8

About 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide

2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide (PubChem CID 119720978) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide
PubChem CID119720978
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide
SMILESCNCC(=O)NC(C)CCc1ccc(OC(C)C)cc1
InChIInChI=1S/C16H26N2O2/c1-12(2)20-15-9-7-14(8-10-15)6-5-13(3)18-16(19)11-17-4/h7-10,12-13,17H,5-6,11H2,1-4H3,(H,18,19)
InChIKeyPIMMXQGYVAUZBT-UHFFFAOYSA-N
XLogP2.13
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-4-(4-propan-2-yloxyphenyl)butan-2-yl]-2-pyrazol-1-ylacetamide
CID 94797701
1-[[2-(4-fluorophenyl)acetyl]amino]-3-[4-(4-propan-2-yloxyphenyl)butan-2-yl]urea
CID 60543893
N-[(2S)-4-phenylbutan-2-yl]-4-propan-2-yloxybenzamide
CID 1263174
N-propan-2-yl-3-(4-propan-2-yloxyphenyl)propanamide
CID 170371171
1-[(4-fluorophenyl)methyl]-3-[4-(4-propan-2-yloxyphenyl)butan-2-yl]urea
CID 60544210
2-[2-(4-propan-2-yloxyphenyl)ethylamino]acetamide
CID 115260110
2-amino-N-[4-(4-methoxyphenyl)butan-2-yl]acetamide
CID 119288095
1-(4-hydroxycyclohexyl)-3-[(2R)-4-(4-propan-2-yloxyphenyl)butan-2-yl]urea
CID 94650228
2-methylsulfonyl-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]benzamide
CID 60533563
N-carbamoyl-3-(4-propan-2-yloxyphenyl)propanamide
CID 173014561
4-(hydroxymethyl)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]piperidine-1-carboxamide
CID 110901487
2-bromo-N-[(2S)-4-(4-propan-2-yloxyphenyl)butan-2-yl]pyridine-3-carboxamide
CID 97223647

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide?
The IUPAC name of 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide (CID 119720978) is 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide is CNCC(=O)NC(C)CCc1ccc(OC(C)C)cc1.
What is the InChIKey of 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide?
The InChIKey is PIMMXQGYVAUZBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(2)20-15-9-7-14(8-10-15)6-5-13(3)18-16(19)11-17-4/h7-10,12-13,17H,5-6,11H2,1-4H3,(H,18,19).
What are the key properties of 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide?
2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]acetamide is sourced from PubChem (CID 119720978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).