2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide

C14H24N2O3 — CID 81088081

IUPAC2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)NC(C)CCc1ccco1
InChIInChI=1S/C14H24N2O3/c1-11(7-8-12-5-3-10-19-12)16-14(17)13(15)6-4-9-18-2/h3,5,10-11,13H,4,6-9,15H2,1-2H3,(H,16,17)
InChIKeyPFNYWTSKZQXYNS-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.47
Rot. Bonds9

About 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide

2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide (PubChem CID 81088081) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide
PubChem CID81088081
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)NC(C)CCc1ccco1
InChIInChI=1S/C14H24N2O3/c1-11(7-8-12-5-3-10-19-12)16-14(17)13(15)6-4-9-18-2/h3,5,10-11,13H,4,6-9,15H2,1-2H3,(H,16,17)
InChIKeyPFNYWTSKZQXYNS-UHFFFAOYSA-N
XLogP1.47
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide
CID 103950106
4-amino-N-[4-(furan-2-yl)butan-2-yl]-2-methylbutanamide
CID 80543903
4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine
CID 82714632
2-amino-N-[1-(furan-2-yl)propan-2-yl]pentanamide
CID 43705248
ethyl N-[4-(furan-2-yl)butan-2-yl]carbamate
CID 60651451
4-(furan-2-yl)-N-[2-(3-methoxypropoxy)ethyl]butan-2-amine
CID 103178791
2-[4-(furan-2-yl)butan-2-ylamino]-4-methoxybutan-1-ol
CID 114210422
N-[4-(furan-2-yl)butan-2-yl]-2-methoxybenzamide
CID 18162458
2-amino-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-5-methoxypentanamide
CID 81088734
2-amino-5-methoxy-N-octan-2-ylpentanamide
CID 81083239
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide?
The IUPAC name of 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide (CID 81088081) is 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide is COCCCC(N)C(=O)NC(C)CCc1ccco1.
What is the InChIKey of 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide?
The InChIKey is PFNYWTSKZQXYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-11(7-8-12-5-3-10-19-12)16-14(17)13(15)6-4-9-18-2/h3,5,10-11,13H,4,6-9,15H2,1-2H3,(H,16,17).
What are the key properties of 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide?
2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide has a molecular weight of 268.36 g/mol, XLogP of 1.47, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide is sourced from PubChem (CID 81088081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).