N,N-dimethyl-2H-pyran-4-amine

C7H11NO — CID 98117654

IUPACN,N-dimethyl-2H-pyran-4-amine
SMILESCN(C)C1=CCOC=C1
InChIInChI=1S/C7H11NO/c1-8(2)7-3-5-9-6-4-7/h3-5H,6H2,1-2H3
InChIKeyKSGWNZYLPHXHEG-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.98
Rot. Bonds1

About N,N-dimethyl-2H-pyran-4-amine

N,N-dimethyl-2H-pyran-4-amine (PubChem CID 98117654) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is N,N-dimethyl-2H-pyran-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-2H-pyran-4-amine
PubChem CID98117654
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC NameN,N-dimethyl-2H-pyran-4-amine
SMILESCN(C)C1=CCOC=C1
InChIInChI=1S/C7H11NO/c1-8(2)7-3-5-9-6-4-7/h3-5H,6H2,1-2H3
InChIKeyKSGWNZYLPHXHEG-UHFFFAOYSA-N
XLogP0.98
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Dimethylamino-2h-pyran
CID 101690097
N-methyl-2H-pyran-4-amine;hydrochloride
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N-methyl-2H-pyran-4-amine
CID 69002805
(3E,5Z)-7-methoxy-N,N-dimethylhepta-1,3,5-trien-4-amine
CID 89360210
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CID 91149823
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CID 132022901
2H-pyrido[1,2-d][1,4]oxazepine
CID 140167275
dimethyl(2H-pyran-4-yl)azanium chloride
CID 140542832
2-methoxy-1-methyl-2H-pyridine
CID 141113178
2,3-Bis(ethenyl)-4-methyl-1,4-oxazine
CID 145268262
potassium;carbanide;3-ethoxy-N,N-dimethylbenzene-4-id-1-amine
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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2H-pyran-4-amine?
The IUPAC name of N,N-dimethyl-2H-pyran-4-amine (CID 98117654) is N,N-dimethyl-2H-pyran-4-amine.
What is the SMILES notation for N,N-dimethyl-2H-pyran-4-amine?
The canonical SMILES for N,N-dimethyl-2H-pyran-4-amine is CN(C)C1=CCOC=C1.
What is the InChIKey of N,N-dimethyl-2H-pyran-4-amine?
The InChIKey is KSGWNZYLPHXHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-8(2)7-3-5-9-6-4-7/h3-5H,6H2,1-2H3.
What are the key properties of N,N-dimethyl-2H-pyran-4-amine?
N,N-dimethyl-2H-pyran-4-amine has a molecular weight of 125.17 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2H-pyran-4-amine is sourced from PubChem (CID 98117654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).