N-[(1R)-1-naphthalen-1-ylethyl]formamide

C13H13NO — CID 87180924

IUPACN-[(1R)-1-naphthalen-1-ylethyl]formamide
SMILESC[C@@H](NC=O)c1cccc2ccccc12
InChIInChI=1S/C13H13NO/c1-10(14-9-15)12-8-4-6-11-5-2-3-7-13(11)12/h2-10H,1H3,(H,14,15)/t10-/m1/s1
InChIKeyLBUNPZWRXVWADJ-SNVBAGLBSA-N
MW199.25 g/mol
LogP2.65
Rot. Bonds3

About N-[(1R)-1-naphthalen-1-ylethyl]formamide

N-[(1R)-1-naphthalen-1-ylethyl]formamide (PubChem CID 87180924) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is N-[(1R)-1-naphthalen-1-ylethyl]formamide.

Molecular Properties

Compound NameN-[(1R)-1-naphthalen-1-ylethyl]formamide
PubChem CID87180924
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC NameN-[(1R)-1-naphthalen-1-ylethyl]formamide
SMILESC[C@@H](NC=O)c1cccc2ccccc12
InChIInChI=1S/C13H13NO/c1-10(14-9-15)12-8-4-6-11-5-2-3-7-13(11)12/h2-10H,1H3,(H,14,15)/t10-/m1/s1
InChIKeyLBUNPZWRXVWADJ-SNVBAGLBSA-N
XLogP2.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N'-(1-naphthalen-1-ylethyl)-N-[(1S)-1-naphthalen-1-ylethyl]oxamide
CID 90809930
2-formamido-2-naphthalen-1-ylacetic acid
CID 63689501
(4S)-4-naphthalen-1-ylpentanal
CID 10774914
lithium bis[[(1S)-1-naphthalen-1-ylethyl]amino]azanide
CID 177413049
N-ethyl-3-naphthalen-1-ylbutan-1-amine
CID 81020058
N-[1-(2-benzothiophen-1-yl)ethyl]formamide
CID 173295255
N-(1-naphthalen-1-ylethyl)propanamide
CID 13202765
[5-[[(1S)-1-naphthalen-1-ylethyl]amino]-1-oxopentan-2-yl]carbamic acid
CID 87552764
(1S)-N-(1-naphthalen-1-ylethyl)-1-phenylethanamine
CID 78956224
2,4,4-trimethyl-N-(1-naphthalen-1-ylethyl)pentan-2-amine
CID 43731152
3-[[(1R)-1-naphthalen-1-ylethyl]amino]but-2-enoic acid
CID 70562047
3-[[(1S)-1-naphthalen-1-ylethyl]amino]but-2-enoic acid
CID 70562068

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-naphthalen-1-ylethyl]formamide?
The IUPAC name of N-[(1R)-1-naphthalen-1-ylethyl]formamide (CID 87180924) is N-[(1R)-1-naphthalen-1-ylethyl]formamide.
What is the SMILES notation for N-[(1R)-1-naphthalen-1-ylethyl]formamide?
The canonical SMILES for N-[(1R)-1-naphthalen-1-ylethyl]formamide is C[C@@H](NC=O)c1cccc2ccccc12.
What is the InChIKey of N-[(1R)-1-naphthalen-1-ylethyl]formamide?
The InChIKey is LBUNPZWRXVWADJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H13NO/c1-10(14-9-15)12-8-4-6-11-5-2-3-7-13(11)12/h2-10H,1H3,(H,14,15)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-naphthalen-1-ylethyl]formamide?
N-[(1R)-1-naphthalen-1-ylethyl]formamide has a molecular weight of 199.25 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-naphthalen-1-ylethyl]formamide is sourced from PubChem (CID 87180924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).