N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide

C15H24N2O — CID 28766915

IUPACN-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide
SMILESCc1cccc(N(CCCN)C(=O)C(C)(C)C)c1
InChIInChI=1S/C15H24N2O/c1-12-7-5-8-13(11-12)17(10-6-9-16)14(18)15(2,3)4/h5,7-8,11H,6,9-10,16H2,1-4H3
InChIKeyWNXRDWPAYUGGNN-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.72
Rot. Bonds4

About N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide

N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide (PubChem CID 28766915) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide
PubChem CID28766915
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide
SMILESCc1cccc(N(CCCN)C(=O)C(C)(C)C)c1
InChIInChI=1S/C15H24N2O/c1-12-7-5-8-13(11-12)17(10-6-9-16)14(18)15(2,3)4/h5,7-8,11H,6,9-10,16H2,1-4H3
InChIKeyWNXRDWPAYUGGNN-UHFFFAOYSA-N
XLogP2.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)butanamide
CID 62677230
N-(3-aminopropyl)-2-methyl-N-(3-methylphenyl)benzamide
CID 28766933
N-(3-aminopropyl)-2-ethoxy-N-(3-methylphenyl)acetamide
CID 43135951
N-butyl-2,2-dimethyl-N-(3-methylphenyl)butanamide
CID 71107115
N-(3-aminopropyl)-N-(3-methylphenyl)cyclohexanecarboxamide
CID 28766909
N-(3-aminopropyl)-1-methyl-N-(3-methylphenyl)cyclohexane-1-carboxamide
CID 106825939
N-(3-aminopropyl)-3-fluoro-N-(3-methylphenyl)benzamide
CID 28766949
N-(3-aminopropyl)-2-methyl-N-(3-methylphenyl)furan-3-carboxamide
CID 43135957
N-(3-aminopropyl)-N-(3-fluorophenyl)-2,2-dimethylbutanamide
CID 62677429
2-amino-N-ethyl-2-methyl-N-(3-methylphenyl)butanamide
CID 79805432
4-amino-N-(3-amino-3-oxopropyl)-N-(3-methylphenyl)butanamide;hydrochloride
CID 119311463
N-(3-aminopropyl)-5-fluoro-N-(3-methylphenyl)pyridine-2-carboxamide
CID 104637909

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide?
The IUPAC name of N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide (CID 28766915) is N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide.
What is the SMILES notation for N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide?
The canonical SMILES for N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide is Cc1cccc(N(CCCN)C(=O)C(C)(C)C)c1.
What is the InChIKey of N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide?
The InChIKey is WNXRDWPAYUGGNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-7-5-8-13(11-12)17(10-6-9-16)14(18)15(2,3)4/h5,7-8,11H,6,9-10,16H2,1-4H3.
What are the key properties of N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide?
N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2,2-dimethyl-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 28766915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).