2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide

C16H22N2O3 — CID 60938301

IUPAC2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)N(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C16H22N2O3/c1-3-12(2)15(17)16(19)18(10-13-6-4-8-20-13)11-14-7-5-9-21-14/h4-9,12,15H,3,10-11,17H2,1-2H3
InChIKeyHCVVZRTUNINWSF-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.77
Rot. Bonds7

About 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide

2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide (PubChem CID 60938301) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide.

Molecular Properties

Compound Name2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide
PubChem CID60938301
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)N(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C16H22N2O3/c1-3-12(2)15(17)16(19)18(10-13-6-4-8-20-13)11-14-7-5-9-21-14/h4-9,12,15H,3,10-11,17H2,1-2H3
InChIKeyHCVVZRTUNINWSF-UHFFFAOYSA-N
XLogP2.77
TPSA72.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)butanamide
CID 54869064
N-ethyl-N-(furan-2-ylmethyl)-2-sulfanylpropanamide
CID 107024393
(2S,3S)-2-amino-N-[2-(furan-2-yl)ethyl]-3-methylpentanamide
CID 61156256
(2R)-2-amino-N-ethyl-N-(furan-2-ylmethyl)pentanamide
CID 107568950
propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
CID 116654523
(2S)-2-amino-N-ethyl-N-(furan-2-ylmethyl)hexanamide
CID 113357146
N,N-bis(furan-2-ylmethyl)-2-propan-2-yloxyacetamide
CID 115593503
(2S)-2-(4-chloro-3,5-dimethylphenoxy)-N,N-bis(furan-2-ylmethyl)propanamide
CID 40639487
2-amino-N-benzyl-N-ethyl-3-methylpentanamide;hydrochloride
CID 119674320
(2R)-2-amino-N-(furan-2-ylmethyl)-4-methyl-N-(thiophen-2-ylmethyl)pentanamide
CID 104903002
3-amino-N-butan-2-yl-N-(furan-2-ylmethyl)propanamide
CID 112501488
2-amino-N-ethyl-N-(furan-2-ylmethyl)-3-(4-hydroxyphenyl)propanamide
CID 76894772

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide?
The IUPAC name of 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide (CID 60938301) is 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide.
What is the SMILES notation for 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide?
The canonical SMILES for 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide is CCC(C)C(N)C(=O)N(Cc1ccco1)Cc1ccco1.
What is the InChIKey of 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide?
The InChIKey is HCVVZRTUNINWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-3-12(2)15(17)16(19)18(10-13-6-4-8-20-13)11-14-7-5-9-21-14/h4-9,12,15H,3,10-11,17H2,1-2H3.
What are the key properties of 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide?
2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide has a molecular weight of 290.36 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N-bis(furan-2-ylmethyl)-3-methylpentanamide is sourced from PubChem (CID 60938301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).