3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide

C15H24N2O — CID 43705485

IUPAC3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide
SMILESCC(C)c1ccc(NC(=O)CCN)c(C(C)C)c1
InChIInChI=1S/C15H24N2O/c1-10(2)12-5-6-14(13(9-12)11(3)4)17-15(18)7-8-16/h5-6,9-11H,7-8,16H2,1-4H3,(H,17,18)
InChIKeyUZFAZVFWAFCBEA-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.22
Rot. Bonds5

About 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide

3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide (PubChem CID 43705485) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide
PubChem CID43705485
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide
SMILESCC(C)c1ccc(NC(=O)CCN)c(C(C)C)c1
InChIInChI=1S/C15H24N2O/c1-10(2)12-5-6-14(13(9-12)11(3)4)17-15(18)7-8-16/h5-6,9-11H,7-8,16H2,1-4H3,(H,17,18)
InChIKeyUZFAZVFWAFCBEA-UHFFFAOYSA-N
XLogP3.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[2,4-di(propan-2-yl)phenyl]pentanamide
CID 43698416
3-amino-N-(2-propan-2-ylphenyl)propanamide;hydrochloride
CID 71828995
3-amino-N-[2,4-di(propan-2-yl)phenyl]-2-methylpropanamide
CID 55105659
1-(aminomethyl)-N-[2,4-di(propan-2-yl)phenyl]cyclopropane-1-carboxamide
CID 115452440
(2S)-2-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide;hydrochloride
CID 119288317
3-amino-N-[2,4-di(propan-2-yl)phenyl]-2-methoxypropanamide
CID 106111576
3-(3,4-dimethoxyphenyl)-N-[2,4-di(propan-2-yl)phenyl]propanamide
CID 34445344
2-(cyclopropylmethylamino)-N-[2,4-di(propan-2-yl)phenyl]acetamide
CID 60866035
3-chloro-N-[2,4-di(propan-2-yl)phenyl]-2,2-dimethylpropanamide
CID 63680547
2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride
CID 120622112
4-amino-N-(2-propan-2-ylphenyl)pentanamide;hydrochloride
CID 120558713
N-[2,4-di(propan-2-yl)phenyl]-3-(ethylamino)-2-methylpropanamide
CID 62852532

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide?
The IUPAC name of 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide (CID 43705485) is 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide.
What is the SMILES notation for 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide?
The canonical SMILES for 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide is CC(C)c1ccc(NC(=O)CCN)c(C(C)C)c1.
What is the InChIKey of 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide?
The InChIKey is UZFAZVFWAFCBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)12-5-6-14(13(9-12)11(3)4)17-15(18)7-8-16/h5-6,9-11H,7-8,16H2,1-4H3,(H,17,18).
What are the key properties of 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide?
3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide has a molecular weight of 248.37 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2,4-di(propan-2-yl)phenyl]propanamide is sourced from PubChem (CID 43705485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).