N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide

C18H24N2O — CID 43319276

IUPACN-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide
SMILESCC(C)N(CCCN)C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C18H24N2O/c1-14(2)20(12-6-11-19)18(21)13-16-9-5-8-15-7-3-4-10-17(15)16/h3-5,7-10,14H,6,11-13,19H2,1-2H3
InChIKeyAJSMSHZZJFXINK-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.97
Rot. Bonds6

About N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide

N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide (PubChem CID 43319276) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide
PubChem CID43319276
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide
SMILESCC(C)N(CCCN)C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C18H24N2O/c1-14(2)20(12-6-11-19)18(21)13-16-9-5-8-15-7-3-4-10-17(15)16/h3-5,7-10,14H,6,11-13,19H2,1-2H3
InChIKeyAJSMSHZZJFXINK-UHFFFAOYSA-N
XLogP2.97
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-N-ethyl-2-naphthalen-1-ylacetamide
CID 61350278
N-(3-hydroxybutyl)-N-methyl-2-naphthalen-1-ylacetamide
CID 111695871
N-(3-chloropropyl)-2-(2-fluorophenyl)-N-propan-2-ylacetamide
CID 55183329
2-(2-aminophenyl)-N-pentyl-N-propan-2-ylacetamide
CID 61105636
2-[butan-2-yl-(2-naphthalen-1-ylacetyl)amino]acetic acid
CID 119955311
phenyl N-(3-aminopropyl)-N-propan-2-ylcarbamate
CID 43137069
N-(3-chloropropyl)-2-(2-hydroxyphenyl)-N-propan-2-ylacetamide
CID 80740905
4-[[2-(2-fluorophenyl)acetyl]-propan-2-ylamino]butanoic acid
CID 60830925
3-methyl-1-naphthalen-1-ylbutan-2-one
CID 12922161
4-amino-3-methyl-1-naphthalen-1-ylbutan-2-one
CID 116564413
3-[methyl-(2-naphthalen-1-ylacetyl)amino]propanoic acid
CID 60989846
N-(3-aminopropyl)-2-methyl-N-propan-2-ylbenzamide
CID 43136684

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide?
The IUPAC name of N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide (CID 43319276) is N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide.
What is the SMILES notation for N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide?
The canonical SMILES for N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide is CC(C)N(CCCN)C(=O)Cc1cccc2ccccc12.
What is the InChIKey of N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide?
The InChIKey is AJSMSHZZJFXINK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-14(2)20(12-6-11-19)18(21)13-16-9-5-8-15-7-3-4-10-17(15)16/h3-5,7-10,14H,6,11-13,19H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide?
N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide has a molecular weight of 284.40 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide is sourced from PubChem (CID 43319276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).