N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide

C10H17NO2 — CID 126999597

IUPACN-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide
SMILESCCC(C)NC(=O)C1=CCCCO1
InChIInChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h6,8H,3-5,7H2,1-2H3,(H,11,12)
InChIKeyGEADASUBUDVJHL-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.60
Rot. Bonds3

About N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide

N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide (PubChem CID 126999597) 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-6-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide
PubChem CID126999597
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide
SMILESCCC(C)NC(=O)C1=CCCCO1
InChIInChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h6,8H,3-5,7H2,1-2H3,(H,11,12)
InChIKeyGEADASUBUDVJHL-UHFFFAOYSA-N
XLogP1.60
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 ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-5-ethoxy-4-oxo-4H-pyran-2-carboxamide
CID 30860241
(3S)-4-(3,4-dihydro-2H-pyran-6-carbonyl)-3-methylpiperazin-2-one
CID 97090915
3,4-dihydro-2H-pyran-6-yl-[(3S)-3-methylmorpholin-4-yl]methanone
CID 97094843
6-Methyl-3-ethoxy-5,6-dihydro-2-pyridinol
CID 134612800
N-[2-[methyl(2,2,2-trifluoroethyl)amino]ethyl]-3,4-dihydro-2H-pyran-6-carboxamide
CID 96568861
N-(2-fluoroethyl)-3,4-dihydro-2H-pyran-6-carboxamide
CID 127017391
N-(1-fluoropropan-2-yl)-3,4-dihydro-2H-pyran-6-carboxamide
CID 130708560
N-cyclopropyl-5-methoxy-4-oxo-4H-pyran-2-carboxamide
CID 27378251
4-ethoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
CID 10678456
3-butoxy-N-butyl-6-methyl-4-oxopyran-2-carboxamide
CID 89390543
N-tert-butyl-3,4-dihydro-2H-pyran-6-carboxamide
CID 126988845
Ethyl 2-[(2-ethyl-5-oxo-1,2-dihydropyrrol-3-yl)oxy]acetate
CID 142849264

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide?
The IUPAC name of N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide (CID 126999597) is N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide.
What is the SMILES notation for N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide?
The canonical SMILES for N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide is CCC(C)NC(=O)C1=CCCCO1.
What is the InChIKey of N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide?
The InChIKey is GEADASUBUDVJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-8(2)11-10(12)9-6-4-5-7-13-9/h6,8H,3-5,7H2,1-2H3,(H,11,12).
What are the key properties of N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide?
N-butan-2-yl-3,4-dihydro-2H-pyran-6-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 1.60, 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-6-carboxamide is sourced from PubChem (CID 126999597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).