N,N-dipropyloxane-4-carboxamide

C12H23NO2 — CID 51073126

IUPACN,N-dipropyloxane-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CCOCC1
InChIInChI=1S/C12H23NO2/c1-3-7-13(8-4-2)12(14)11-5-9-15-10-6-11/h11H,3-10H2,1-2H3
InChIKeyPMDRYRUDICEANL-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.06
Rot. Bonds5

About N,N-dipropyloxane-4-carboxamide

N,N-dipropyloxane-4-carboxamide (PubChem CID 51073126) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N,N-dipropyloxane-4-carboxamide.

Molecular Properties

Compound NameN,N-dipropyloxane-4-carboxamide
PubChem CID51073126
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN,N-dipropyloxane-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CCOCC1
InChIInChI=1S/C12H23NO2/c1-3-7-13(8-4-2)12(14)11-5-9-15-10-6-11/h11H,3-10H2,1-2H3
InChIKeyPMDRYRUDICEANL-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(tetrahydro-2H-pyran-4-ylmethyl)-1-cyclobutanecarboxamide
CID 110752448
Ethyl 1-acetylpiperidine-4-carboxylate
CID 690430
Ethyl 1-(3-methylbutanoyl)piperidine-4-carboxylate
CID 670003
1-(Oxane-4-carbonyl)piperidine
CID 24229804
N-Methyl-N-[(oxan-4-YL)methyl]pentanamide
CID 91915004
N-cyclohexyl-N-methyloxane-4-carboxamide
CID 51074436
1-[4-(2-Methoxyethoxymethyl)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 49670829
2-Ethyl-1-[4-(2-methoxyethyl)piperidin-1-yl]butan-1-one
CID 53150825
N-methyl-N-(oxan-4-ylmethyl)butanamide
CID 64592636
N-Methyl-N-[(oxan-4-YL)methyl]cyclopentanecarboxamide
CID 110752398
N,N-Dimethyloxane-4-carboxamide
CID 23091622
N-(3-ethoxypropyl)oxane-4-carboxamide
CID 51073129

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyloxane-4-carboxamide?
The IUPAC name of N,N-dipropyloxane-4-carboxamide (CID 51073126) is N,N-dipropyloxane-4-carboxamide.
What is the SMILES notation for N,N-dipropyloxane-4-carboxamide?
The canonical SMILES for N,N-dipropyloxane-4-carboxamide is CCCN(CCC)C(=O)C1CCOCC1.
What is the InChIKey of N,N-dipropyloxane-4-carboxamide?
The InChIKey is PMDRYRUDICEANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-7-13(8-4-2)12(14)11-5-9-15-10-6-11/h11H,3-10H2,1-2H3.
What are the key properties of N,N-dipropyloxane-4-carboxamide?
N,N-dipropyloxane-4-carboxamide has a molecular weight of 213.32 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyloxane-4-carboxamide is sourced from PubChem (CID 51073126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).