2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide

C13H18N2O2 — CID 119325506

IUPAC2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide
SMILESNCC(=O)NCc1ccccc1OCC1CC1
InChIInChI=1S/C13H18N2O2/c14-7-13(16)15-8-11-3-1-2-4-12(11)17-9-10-5-6-10/h1-4,10H,5-9,14H2,(H,15,16)
InChIKeyLDWIKLYRQWLZMR-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.05
Rot. Bonds6

About 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide

2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide (PubChem CID 119325506) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide
PubChem CID119325506
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide
SMILESNCC(=O)NCc1ccccc1OCC1CC1
InChIInChI=1S/C13H18N2O2/c14-7-13(16)15-8-11-3-1-2-4-12(11)17-9-10-5-6-10/h1-4,10H,5-9,14H2,(H,15,16)
InChIKeyLDWIKLYRQWLZMR-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(2-ethoxyphenyl)methyl]acetamide;hydrochloride
CID 119279613
2-amino-N-[(2-cyclopentyloxyphenyl)methyl]acetamide
CID 119284470
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methyl-3-(methylamino)propanamide
CID 119786909
3-amino-N-[(2-ethoxyphenyl)methyl]propanamide
CID 82677450
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 71930246
5-[[2-(cyclopropylmethoxy)phenyl]methylcarbamoyl]pyridine-2-carboxylic acid
CID 119137622
1-[2-(cyclopropylmethoxy)phenyl]-N-methoxymethanamine
CID 117296327
1-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methyl-3-propylguanidine
CID 111577185
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 136527258
N-cyclopropyl-4-[[N-[[2-(cyclopropylmethoxy)phenyl]methyl]-N'-methylcarbamimidoyl]amino]butanamide;hydroiodide
CID 111576967
2-[[N-[[2-(cyclopropylmethoxy)phenyl]methyl]-N'-methylcarbamimidoyl]amino]-N-(4-fluorophenyl)acetamide
CID 111576801
1-butyl-3-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methylguanidine
CID 111576783

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide?
The IUPAC name of 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide (CID 119325506) is 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide.
What is the SMILES notation for 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide?
The canonical SMILES for 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide is NCC(=O)NCc1ccccc1OCC1CC1.
What is the InChIKey of 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide?
The InChIKey is LDWIKLYRQWLZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-7-13(16)15-8-11-3-1-2-4-12(11)17-9-10-5-6-10/h1-4,10H,5-9,14H2,(H,15,16).
What are the key properties of 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide?
2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[2-(cyclopropylmethoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 119325506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).