N-benzyl-N-[8-(dimethylamino)octyl]formamide

C18H30N2O — CID 173398538

IUPACN-benzyl-N-[8-(dimethylamino)octyl]formamide
SMILESCN(C)CCCCCCCCN(C=O)Cc1ccccc1
InChIInChI=1S/C18H30N2O/c1-19(2)14-10-5-3-4-6-11-15-20(17-21)16-18-12-8-7-9-13-18/h7-9,12-13,17H,3-6,10-11,14-16H2,1-2H3
InChIKeyXKRGRFRTYQGHMA-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.55
Rot. Bonds12

About N-benzyl-N-[8-(dimethylamino)octyl]formamide

N-benzyl-N-[8-(dimethylamino)octyl]formamide (PubChem CID 173398538) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-benzyl-N-[8-(dimethylamino)octyl]formamide.

Molecular Properties

Compound NameN-benzyl-N-[8-(dimethylamino)octyl]formamide
PubChem CID173398538
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-benzyl-N-[8-(dimethylamino)octyl]formamide
SMILESCN(C)CCCCCCCCN(C=O)Cc1ccccc1
InChIInChI=1S/C18H30N2O/c1-19(2)14-10-5-3-4-6-11-15-20(17-21)16-18-12-8-7-9-13-18/h7-9,12-13,17H,3-6,10-11,14-16H2,1-2H3
InChIKeyXKRGRFRTYQGHMA-UHFFFAOYSA-N
XLogP3.55
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-dibenzylformamide;N,N-diethylformamide;methane
CID 160532713
N,N-dimethyl-18-phenyloctadecan-1-amine;hydrochloride
CID 173450545
N,N-dimethyl-9-phenylnonan-1-amine;hydrochloride
CID 173027256
N,N-dimethyl-7-phenylheptan-1-amine;hydrate
CID 173447731
9-[benzyl(methyl)amino]nonane-1-thiol
CID 105344021
N-benzyl-N-hexylmethanethioamide
CID 54136238
N-benzyl-N-[2-[3-(dibenzylamino)propylamino]ethyl]formamide
CID 143178304
N-benzyl-N-(cyclopropylmethyl)formamide
CID 174364341
N-[(4-fluorophenyl)methyl]-N-pentylformamide
CID 177471699
N-benzyl-N-[3-(1H-imidazol-5-yl)propyl]formamide
CID 142002691
N'-benzyl-N-[2-(dimethylamino)ethyl]-N'-methylpropane-1,3-diamine
CID 28577551
N,N-dimethyldecan-1-amine;2-oxo-3-phenylpropanoate
CID 163981787

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[8-(dimethylamino)octyl]formamide?
The IUPAC name of N-benzyl-N-[8-(dimethylamino)octyl]formamide (CID 173398538) is N-benzyl-N-[8-(dimethylamino)octyl]formamide.
What is the SMILES notation for N-benzyl-N-[8-(dimethylamino)octyl]formamide?
The canonical SMILES for N-benzyl-N-[8-(dimethylamino)octyl]formamide is CN(C)CCCCCCCCN(C=O)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-[8-(dimethylamino)octyl]formamide?
The InChIKey is XKRGRFRTYQGHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-19(2)14-10-5-3-4-6-11-15-20(17-21)16-18-12-8-7-9-13-18/h7-9,12-13,17H,3-6,10-11,14-16H2,1-2H3.
What are the key properties of N-benzyl-N-[8-(dimethylamino)octyl]formamide?
N-benzyl-N-[8-(dimethylamino)octyl]formamide has a molecular weight of 290.45 g/mol, XLogP of 3.55, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[8-(dimethylamino)octyl]formamide is sourced from PubChem (CID 173398538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).