N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide

C10H17NO2 — CID 130747082

IUPACN-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide
SMILESCCC(C)NC(=O)C1CCC=CO1
InChIInChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h5,7-9H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyWLWZFWYNIPJRMP-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.59
Rot. Bonds3

About N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide

N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide (PubChem CID 130747082) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide
PubChem CID130747082
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide
SMILESCCC(C)NC(=O)C1CCC=CO1
InChIInChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h5,7-9H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyWLWZFWYNIPJRMP-UHFFFAOYSA-N
XLogP1.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoroethyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 126996521
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2-fluoro-2-methylpropanamide
CID 130783856
4-methyl-N-propan-2-yl-2-prop-2-enoxypent-4-enamide
CID 21366283
2-ethoxy-4-methyl-N-propan-2-ylpent-4-enamide
CID 21366326
4-methyl-N-propan-2-yl-2-propoxypent-4-enamide
CID 21366394
N-methyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 131225571
(2R,3R,4S)-3-acetamido-4-amino-N-propyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 140985242
N,N-diethyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 141178157
ethane;N-ethyl-2,3-dihydrofuran-2-carboxamide
CID 141975351
N-heptyl-2,3-dihydrofuran-2-carboxamide
CID 178143014
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N-ethylpropanamide
CID 62064202
1-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]-2-methoxyethanone
CID 62064231

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide?
The IUPAC name of N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide (CID 130747082) is N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide.
What is the SMILES notation for N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide?
The canonical SMILES for N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide is CCC(C)NC(=O)C1CCC=CO1.
What is the InChIKey of N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide?
The InChIKey is WLWZFWYNIPJRMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h5,7-9H,3-4,6H2,1-2H3,(H,11,12).
What are the key properties of N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide?
N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide is sourced from PubChem (CID 130747082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).