2-amino-N-[2-(furan-2-yl)ethyl]butanamide

C10H16N2O2 — CID 43649605

IUPAC2-amino-N-[2-(furan-2-yl)ethyl]butanamide
SMILESCCC(N)C(=O)NCCc1ccco1
InChIInChI=1S/C10H16N2O2/c1-2-9(11)10(13)12-6-5-8-4-3-7-14-8/h3-4,7,9H,2,5-6,11H2,1H3,(H,12,13)
InChIKeyXKTVHCZXNUBGTA-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.68
Rot. Bonds5

About 2-amino-N-[2-(furan-2-yl)ethyl]butanamide

2-amino-N-[2-(furan-2-yl)ethyl]butanamide (PubChem CID 43649605) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-amino-N-[2-(furan-2-yl)ethyl]butanamide.

Molecular Properties

Compound Name2-amino-N-[2-(furan-2-yl)ethyl]butanamide
PubChem CID43649605
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-amino-N-[2-(furan-2-yl)ethyl]butanamide
SMILESCCC(N)C(=O)NCCc1ccco1
InChIInChI=1S/C10H16N2O2/c1-2-9(11)10(13)12-6-5-8-4-3-7-14-8/h3-4,7,9H,2,5-6,11H2,1H3,(H,12,13)
InChIKeyXKTVHCZXNUBGTA-UHFFFAOYSA-N
XLogP0.68
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-(furan-2-yl)ethyl]propanamide
CID 61147120
(2S,3S)-2-amino-N-[2-(furan-2-yl)ethyl]-3-methylpentanamide
CID 61156256
4-amino-5-[2-(furan-2-yl)ethylamino]-5-oxopentanoic acid
CID 64895823
3-[2-(furan-2-yl)ethylamino]-2-methyl-3-oxopropanoic acid
CID 114897735
(2S)-2-amino-N-[2-[2-(furan-2-yl)ethylamino]-2-oxoethyl]-3-methylbutanamide
CID 82961514
N-[2-(furan-2-yl)ethyl]-2-methylprop-2-enamide
CID 178173949
3-amino-N-[2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 61140792
3-amino-N-[2-(furan-2-yl)ethyl]-2-hydroxybenzamide
CID 113386431
N-[2-(furan-2-yl)ethyl]-4-hydroxypentanamide
CID 79201221
3-(ethylamino)-N-[2-(furan-2-yl)ethyl]propanamide
CID 62831565
N-[2-(furan-2-yl)ethyl]-3-phenyl-2-sulfanylpropanamide
CID 107025115
(3S)-3-amino-N-[2-(furan-2-yl)ethyl]-3-(2-methylphenyl)propanamide
CID 71257877

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(furan-2-yl)ethyl]butanamide?
The IUPAC name of 2-amino-N-[2-(furan-2-yl)ethyl]butanamide (CID 43649605) is 2-amino-N-[2-(furan-2-yl)ethyl]butanamide.
What is the SMILES notation for 2-amino-N-[2-(furan-2-yl)ethyl]butanamide?
The canonical SMILES for 2-amino-N-[2-(furan-2-yl)ethyl]butanamide is CCC(N)C(=O)NCCc1ccco1.
What is the InChIKey of 2-amino-N-[2-(furan-2-yl)ethyl]butanamide?
The InChIKey is XKTVHCZXNUBGTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-2-9(11)10(13)12-6-5-8-4-3-7-14-8/h3-4,7,9H,2,5-6,11H2,1H3,(H,12,13).
What are the key properties of 2-amino-N-[2-(furan-2-yl)ethyl]butanamide?
2-amino-N-[2-(furan-2-yl)ethyl]butanamide has a molecular weight of 196.25 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(furan-2-yl)ethyl]butanamide is sourced from PubChem (CID 43649605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).