N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide

C11H17NO3 — CID 61040244

IUPACN-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)N(CCCO)C(=O)c1ccco1
InChIInChI=1S/C11H17NO3/c1-9(2)12(6-4-7-13)11(14)10-5-3-8-15-10/h3,5,8-9,13H,4,6-7H2,1-2H3
InChIKeyIWAVXVWGDQKRKV-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.51
Rot. Bonds5

About N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide

N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide (PubChem CID 61040244) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide
PubChem CID61040244
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide
SMILESCC(C)N(CCCO)C(=O)c1ccco1
InChIInChI=1S/C11H17NO3/c1-9(2)12(6-4-7-13)11(14)10-5-3-8-15-10/h3,5,8-9,13H,4,6-7H2,1-2H3
InChIKeyIWAVXVWGDQKRKV-UHFFFAOYSA-N
XLogP1.51
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxypropyl)-3-methyl-N-propan-2-ylfuran-2-carboxamide
CID 61038775
N-(3-hydroxypropyl)-N-propan-2-yl-1-benzofuran-2-carboxamide
CID 54916950
N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
CID 15134402
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
N-ethyl-N-(2-hydroxyethyl)furan-2-carboxamide
CID 39237533
5-(diethylaminomethyl)-N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide
CID 61040008
N-(3-hydroxypropyl)-4-iodo-N-propan-2-ylbenzamide
CID 61040122
N-[(1-benzylpyrrol-2-yl)methyl]-N-propan-2-ylfuran-2-carboxamide
CID 810205
N-(3-hydroxypropyl)-4-(methoxymethyl)-N-propan-2-ylbenzamide
CID 54916378
N-[2-[ethyl(3-hydroxypropyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 104709123
N-butyl-N-methylfuran-2-carboxamide
CID 60670878
3-chloro-N-(3-hydroxypropyl)-2-methyl-N-propan-2-ylbenzamide
CID 107097730

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide (CID 61040244) is N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide is CC(C)N(CCCO)C(=O)c1ccco1.
What is the InChIKey of N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide?
The InChIKey is IWAVXVWGDQKRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-9(2)12(6-4-7-13)11(14)10-5-3-8-15-10/h3,5,8-9,13H,4,6-7H2,1-2H3.
What are the key properties of N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide?
N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-N-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 61040244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).