N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide

C16H22N2O — CID 19773373

IUPACN-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)Nc1cccc2c1CCC(CC1CC1)C2N
InChIInChI=1S/C16H22N2O/c1-10(19)18-15-4-2-3-14-13(15)8-7-12(16(14)17)9-11-5-6-11/h2-4,11-12,16H,5-9,17H2,1H3,(H,18,19)
InChIKeyBBJADDOTAICLFT-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.01
Rot. Bonds3

About N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide

N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 19773373) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound NameN-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
PubChem CID19773373
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)Nc1cccc2c1CCC(CC1CC1)C2N
InChIInChI=1S/C16H22N2O/c1-10(19)18-15-4-2-3-14-13(15)8-7-12(16(14)17)9-11-5-6-11/h2-4,11-12,16H,5-9,17H2,1H3,(H,18,19)
InChIKeyBBJADDOTAICLFT-UHFFFAOYSA-N
XLogP3.01
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide (CID 19773373) is N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide is CC(=O)Nc1cccc2c1CCC(CC1CC1)C2N.
What is the InChIKey of N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is BBJADDOTAICLFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-10(19)18-15-4-2-3-14-13(15)8-7-12(16(14)17)9-11-5-6-11/h2-4,11-12,16H,5-9,17H2,1H3,(H,18,19).
What are the key properties of N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide?
N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 258.36 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-amino-6-(cyclopropylmethyl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 19773373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).