N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide

C11H18N2O2 — CID 106164752

IUPACN-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide
SMILESCCC(C)(CCN)NC(=O)c1ccco1
InChIInChI=1S/C11H18N2O2/c1-3-11(2,6-7-12)13-10(14)9-5-4-8-15-9/h4-5,8H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyJNVMWJHUYQYWMQ-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.53
Rot. Bonds5

About N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide

N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide (PubChem CID 106164752) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide
PubChem CID106164752
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide
SMILESCCC(C)(CCN)NC(=O)c1ccco1
InChIInChI=1S/C11H18N2O2/c1-3-11(2,6-7-12)13-10(14)9-5-4-8-15-9/h4-5,8H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyJNVMWJHUYQYWMQ-UHFFFAOYSA-N
XLogP1.53
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(1-hydroxy-3-methylpentan-3-yl)amino]-2-oxoethyl]furan-2-carboxamide
CID 104709146
N-(4-amino-2,2-dimethylbutyl)furan-2-carboxamide
CID 106139844
N-[3-(bromomethyl)pentan-3-yl]furan-2-carboxamide
CID 114315324
N-[3-[(1-hydroxy-2-methylbutan-2-yl)amino]-3-oxopropyl]furan-2-carboxamide
CID 64555440
N-(1-amino-3-methylpentan-3-yl)-3-hydroxybenzamide
CID 106164117
N-[2-[(2-amino-2-methylpropanoyl)amino]ethyl]furan-2-carboxamide
CID 119278256
N-(1-amino-3-methylpentan-3-yl)-3-fluorobenzamide
CID 106164885
N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114152459
N-(1-aminopentan-3-yl)furan-2-carboxamide
CID 62653791
N-[2-(2-fluorophenyl)propan-2-yl]furan-2-carboxamide
CID 110443410
ethyl (2R)-2-(furan-2-carbonylamino)-2-naphthalen-2-ylpropanoate
CID 66813687
5-(aminomethyl)-N-(3-methylpentan-3-yl)furan-2-carboxamide
CID 103811384

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide?
The IUPAC name of N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide (CID 106164752) is N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide.
What is the SMILES notation for N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide?
The canonical SMILES for N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide is CCC(C)(CCN)NC(=O)c1ccco1.
What is the InChIKey of N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide?
The InChIKey is JNVMWJHUYQYWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-3-11(2,6-7-12)13-10(14)9-5-4-8-15-9/h4-5,8H,3,6-7,12H2,1-2H3,(H,13,14).
What are the key properties of N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide?
N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-methylpentan-3-yl)furan-2-carboxamide is sourced from PubChem (CID 106164752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).