(2S)-2-amino-4-naphthalen-1-yloxybutanamide

C14H16N2O2 — CID 174561854

IUPAC(2S)-2-amino-4-naphthalen-1-yloxybutanamide
SMILESNC(=O)[C@@H](N)CCOc1cccc2ccccc12
InChIInChI=1S/C14H16N2O2/c15-12(14(16)17)8-9-18-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12H,8-9,15H2,(H2,16,17)/t12-/m0/s1
InChIKeyPWIGFANRDJXDKN-LBPRGKRZSA-N
MW244.29 g/mol
LogP1.42
Rot. Bonds5

About (2S)-2-amino-4-naphthalen-1-yloxybutanamide

(2S)-2-amino-4-naphthalen-1-yloxybutanamide (PubChem CID 174561854) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (2S)-2-amino-4-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound Name(2S)-2-amino-4-naphthalen-1-yloxybutanamide
PubChem CID174561854
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(2S)-2-amino-4-naphthalen-1-yloxybutanamide
SMILESNC(=O)[C@@H](N)CCOc1cccc2ccccc12
InChIInChI=1S/C14H16N2O2/c15-12(14(16)17)8-9-18-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12H,8-9,15H2,(H2,16,17)/t12-/m0/s1
InChIKeyPWIGFANRDJXDKN-LBPRGKRZSA-N
XLogP1.42
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-naphthalen-1-yloxybutanamide
CID 63040100
2-methyl-5-naphthalen-1-yloxypentanamide
CID 142457720
bis(2-naphthalen-1-yloxyethyl) carbonate
CID 57035339
(2S)-2-amino-4-methyl-N-(2-naphthalen-1-yloxyethyl)pentanamide
CID 119738781
2-naphthalen-1-yloxyethyl acetate
CID 23049663
1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine
CID 19884989
2-amino-4-(2,4-difluorophenoxy)butanamide
CID 63038942
2-naphthalen-1-yloxyethyl 3-oxopropanoate
CID 23049691
(2S)-2-amino-6-naphthalen-1-yloxyhexane-1-thiol
CID 87875984
1-(4-methylpentoxy)naphthalene
CID 83168126
2-(3-naphthalen-1-yloxypropyl)guanidine
CID 95456191
naphthalen-1-yl (2R)-2-aminopropanoate
CID 18639263

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-naphthalen-1-yloxybutanamide?
The IUPAC name of (2S)-2-amino-4-naphthalen-1-yloxybutanamide (CID 174561854) is (2S)-2-amino-4-naphthalen-1-yloxybutanamide.
What is the SMILES notation for (2S)-2-amino-4-naphthalen-1-yloxybutanamide?
The canonical SMILES for (2S)-2-amino-4-naphthalen-1-yloxybutanamide is NC(=O)[C@@H](N)CCOc1cccc2ccccc12.
What is the InChIKey of (2S)-2-amino-4-naphthalen-1-yloxybutanamide?
The InChIKey is PWIGFANRDJXDKN-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H16N2O2/c15-12(14(16)17)8-9-18-13-7-3-5-10-4-1-2-6-11(10)13/h1-7,12H,8-9,15H2,(H2,16,17)/t12-/m0/s1.
What are the key properties of (2S)-2-amino-4-naphthalen-1-yloxybutanamide?
(2S)-2-amino-4-naphthalen-1-yloxybutanamide has a molecular weight of 244.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 174561854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).