N,N'-dipentylmethanimidamide

C11H24N2 — CID 87074104

IUPACN,N'-dipentylmethanimidamide
SMILESCCCCC/N=C/NCCCCC
InChIInChI=1S/C11H24N2/c1-3-5-7-9-12-11-13-10-8-6-4-2/h11H,3-10H2,1-2H3,(H,12,13)
InChIKeyKPIYEWNIWXSXFG-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.98
Rot. Bonds9

About N,N'-dipentylmethanimidamide

N,N'-dipentylmethanimidamide (PubChem CID 87074104) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N,N'-dipentylmethanimidamide.

Molecular Properties

Compound NameN,N'-dipentylmethanimidamide
PubChem CID87074104
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN,N'-dipentylmethanimidamide
SMILESCCCCC/N=C/NCCCCC
InChIInChI=1S/C11H24N2/c1-3-5-7-9-12-11-13-10-8-6-4-2/h11H,3-10H2,1-2H3,(H,12,13)
InChIKeyKPIYEWNIWXSXFG-UHFFFAOYSA-N
XLogP2.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

ethane;N-pentylformamide
CID 145350301
N-tetracosylformamide
CID 54077607
N-pentacosylformamide
CID 88723962
N-ethenylpentan-1-amine
CID 87131661
N-ethenyltetradecan-1-amine
CID 175788828
N-[(E)-prop-1-enyl]dodecan-1-amine
CID 88674859
N-hexyldecan-1-imine
CID 174719675
N,N'-didecylpentane-1,5-diimine
CID 118371796
N-pentacosylhexacosan-1-imine
CID 21412184
N-hexacosylheptacosan-1-imine
CID 88829034
lithium;N-hexylethanimine;hydride
CID 174719664
N-tetradecyltridecan-1-imine
CID 175147598

Frequently Asked Questions

What is the IUPAC name of N,N'-dipentylmethanimidamide?
The IUPAC name of N,N'-dipentylmethanimidamide (CID 87074104) is N,N'-dipentylmethanimidamide.
What is the SMILES notation for N,N'-dipentylmethanimidamide?
The canonical SMILES for N,N'-dipentylmethanimidamide is CCCCC/N=C/NCCCCC.
What is the InChIKey of N,N'-dipentylmethanimidamide?
The InChIKey is KPIYEWNIWXSXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-3-5-7-9-12-11-13-10-8-6-4-2/h11H,3-10H2,1-2H3,(H,12,13).
What are the key properties of N,N'-dipentylmethanimidamide?
N,N'-dipentylmethanimidamide has a molecular weight of 184.33 g/mol, XLogP of 2.98, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipentylmethanimidamide is sourced from PubChem (CID 87074104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).