N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

C16H24N2O — CID 62718722

IUPACN-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCCC(CCN)NC(=O)C1CCCc2ccccc21
InChIInChI=1S/C16H24N2O/c1-2-13(10-11-17)18-16(19)15-9-5-7-12-6-3-4-8-14(12)15/h3-4,6,8,13,15H,2,5,7,9-11,17H2,1H3,(H,18,19)
InChIKeyFOUVXUUIMLNONJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.35
Rot. Bonds5

About N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide (PubChem CID 62718722) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
PubChem CID62718722
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESCCC(CCN)NC(=O)C1CCCc2ccccc21
InChIInChI=1S/C16H24N2O/c1-2-13(10-11-17)18-16(19)15-9-5-7-12-6-3-4-8-14(12)15/h3-4,6,8,13,15H,2,5,7,9-11,17H2,1H3,(H,18,19)
InChIKeyFOUVXUUIMLNONJ-UHFFFAOYSA-N
XLogP2.35
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-aminobutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 63755728
N-(1-bromobutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 114307725
N-(4-hydroxy-1-methoxybutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 103799339
N-(2-amino-1-cyclohexylethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 119591602
N-(3-oxobutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 64996915
N-(4-hydroxy-3-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 115734909
N-(2-hydroxybutyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 113492689
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 79245874
methyl 3-methyl-2-(1,2,3,4-tetrahydronaphthalene-1-carbonylamino)butanoate
CID 43423445
N-benzhydryl-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 57256640
N-[1-(1H-1,2,4-triazol-5-yl)ethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 103716538
N-(2-aminoethyl)-N-pentan-3-yl-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 63754765

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The IUPAC name of N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide (CID 62718722) is N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide.
What is the SMILES notation for N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The canonical SMILES for N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide is CCC(CCN)NC(=O)C1CCCc2ccccc21.
What is the InChIKey of N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The InChIKey is FOUVXUUIMLNONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-13(10-11-17)18-16(19)15-9-5-7-12-6-3-4-8-14(12)15/h3-4,6,8,13,15H,2,5,7,9-11,17H2,1H3,(H,18,19).
What are the key properties of N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide is sourced from PubChem (CID 62718722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).