2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide

C15H26N2O2 — CID 55081261

IUPAC2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide
SMILESCCCC(CN)(CCC)C(=O)NCc1ccc(C)o1
InChIInChI=1S/C15H26N2O2/c1-4-8-15(11-16,9-5-2)14(18)17-10-13-7-6-12(3)19-13/h6-7H,4-5,8-11,16H2,1-3H3,(H,17,18)
InChIKeyNOVLSCMJEDHSEK-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.75
Rot. Bonds8

About 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide

2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide (PubChem CID 55081261) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide
PubChem CID55081261
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide
SMILESCCCC(CN)(CCC)C(=O)NCc1ccc(C)o1
InChIInChI=1S/C15H26N2O2/c1-4-8-15(11-16,9-5-2)14(18)17-10-13-7-6-12(3)19-13/h6-7H,4-5,8-11,16H2,1-3H3,(H,17,18)
InChIKeyNOVLSCMJEDHSEK-UHFFFAOYSA-N
XLogP2.75
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[(6-methyl-2-pyridinyl)methyl]-2-propylpentanamide
CID 62322495
1-(2-fluoroethyl)-3-[(5-methylfuran-2-yl)methyl]urea
CID 25119845
3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 62524542
3-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 81087637
methyl 2-[(5-methylfuran-2-yl)methylamino]-2-oxoacetate
CID 112617149
5-amino-4-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 82012174
3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 110731621
3-(ethylamino)-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 62834819
3-amino-N-[(5-methylfuran-2-yl)methyl]-2-phenylpropanamide
CID 62879092
2-amino-5-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 62523939
2,2-dimethyl-3-[(5-methylfuran-2-yl)methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 64835246
2-[1-(aminomethyl)cyclohexyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 104678131

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide?
The IUPAC name of 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide (CID 55081261) is 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide.
What is the SMILES notation for 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide?
The canonical SMILES for 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide is CCCC(CN)(CCC)C(=O)NCc1ccc(C)o1.
What is the InChIKey of 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide?
The InChIKey is NOVLSCMJEDHSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-8-15(11-16,9-5-2)14(18)17-10-13-7-6-12(3)19-13/h6-7H,4-5,8-11,16H2,1-3H3,(H,17,18).
What are the key properties of 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide?
2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide has a molecular weight of 266.38 g/mol, XLogP of 2.75, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-2-propylpentanamide is sourced from PubChem (CID 55081261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).