N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide

C16H26N2O3 — CID 7297504

IUPACN-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide
SMILESCC[C@H](C)N(CCC(=O)NCC(C)C)C(=O)c1ccoc1
InChIInChI=1S/C16H26N2O3/c1-5-13(4)18(16(20)14-7-9-21-11-14)8-6-15(19)17-10-12(2)3/h7,9,11-13H,5-6,8,10H2,1-4H3,(H,17,19)/t13-/m0/s1
InChIKeyCPYRBVDDKBGYHW-ZDUSSCGKSA-N
MW294.39 g/mol
LogP2.68
Rot. Bonds8

About N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide

N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide (PubChem CID 7297504) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide
PubChem CID7297504
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC NameN-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide
SMILESCC[C@H](C)N(CCC(=O)NCC(C)C)C(=O)c1ccoc1
InChIInChI=1S/C16H26N2O3/c1-5-13(4)18(16(20)14-7-9-21-11-14)8-6-15(19)17-10-12(2)3/h7,9,11-13H,5-6,8,10H2,1-4H3,(H,17,19)/t13-/m0/s1
InChIKeyCPYRBVDDKBGYHW-ZDUSSCGKSA-N
XLogP2.68
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-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-butan-2-yl-N-butylfuran-3-carboxamide
CID 78858377
3-[acetyl(butan-2-yl)amino]-N-(2-methylpropyl)propanamide
CID 113116111
N-[3-[[(2R)-butan-2-yl]amino]-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 7330670
N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
CID 42779595
N-(2-aminoethyl)-N-propan-2-ylfuran-3-carboxamide
CID 61350095
N-[3-(butan-2-ylamino)-3-oxopropyl]-N-pentylfuran-3-carboxamide
CID 4191902
N,N-bis(3-methylbutyl)furan-3-carboxamide
CID 78833315
N-[3-(furan-2-ylmethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 4685025
N-benzyl-N-[3-(butan-2-ylamino)-3-oxopropyl]furan-3-carboxamide
CID 42780168
N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 4651219
3-[butan-2-yl(methylsulfonyl)amino]-N-(2-methylpropyl)propanamide
CID 113137004
N-[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
CID 1030415

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide?
The IUPAC name of N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide (CID 7297504) is N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide.
What is the SMILES notation for N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide?
The canonical SMILES for N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide is CC[C@H](C)N(CCC(=O)NCC(C)C)C(=O)c1ccoc1.
What is the InChIKey of N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide?
The InChIKey is CPYRBVDDKBGYHW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-5-13(4)18(16(20)14-7-9-21-11-14)8-6-15(19)17-10-12(2)3/h7,9,11-13H,5-6,8,10H2,1-4H3,(H,17,19)/t13-/m0/s1.
What are the key properties of N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide?
N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide has a molecular weight of 294.39 g/mol, XLogP of 2.68, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide is sourced from PubChem (CID 7297504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).