N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide

C14H26N2O — CID 107206759

IUPACN-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCN(CCCCCN)C(=O)C1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-16(8-4-2-3-7-15)14(17)13-10-11-5-6-12(13)9-11/h11-13H,2-10,15H2,1H3
InChIKeyYHBVBIUCBMXTQM-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.01
Rot. Bonds6

About N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide

N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 107206759) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
PubChem CID107206759
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCN(CCCCCN)C(=O)C1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-16(8-4-2-3-7-15)14(17)13-10-11-5-6-12(13)9-11/h11-13H,2-10,15H2,1H3
InChIKeyYHBVBIUCBMXTQM-UHFFFAOYSA-N
XLogP2.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(5-chloropentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 107205733
N-(5-bromopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 107206135
N-(3-aminopropyl)-N-propylbicyclo[2.2.1]heptane-2-carboxamide
CID 61363750
N-(5-aminopentyl)-N-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 107206590
N-(5-aminopentyl)-N-methylcyclobutanecarboxamide
CID 107206716
N-(3-aminopropyl)-N,2-dimethylcyclopentane-1-carboxamide
CID 107174467
N-(5-aminopentyl)-N-methylbicyclo[3.1.0]hexane-6-carboxamide
CID 107206663
(1S,2R,4S)-N,N-dimethylbicyclo[2.2.1]heptane-2-carboxamide
CID 100572588
N-(4-aminobutyl)-N-methylcyclohexanecarboxamide
CID 67635638
methyl 2-[bicyclo[2.2.1]heptane-2-carbonyl(methyl)amino]acetate
CID 43409497
N-(5-aminopentyl)-N-methyloxolane-3-carboxamide
CID 107206578
N-(3-aminopropyl)-2-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-N-methylacetamide
CID 55233822

Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide (CID 107206759) is N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide is CN(CCCCCN)C(=O)C1CC2CCC1C2.
What is the InChIKey of N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is YHBVBIUCBMXTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-16(8-4-2-3-7-15)14(17)13-10-11-5-6-12(13)9-11/h11-13H,2-10,15H2,1H3.
What are the key properties of N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide?
N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentyl)-N-methylbicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 107206759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).