N-(5-amino-5-sulfanylidenepentyl)formamide

C6H12N2OS — CID 64992008

IUPACN-(5-amino-5-sulfanylidenepentyl)formamide
SMILESNC(=S)CCCCNC=O
InChIInChI=1S/C6H12N2OS/c7-6(10)3-1-2-4-8-5-9/h5H,1-4H2,(H2,7,10)(H,8,9)
InChIKeyFLUNHDXEGFTBLE-UHFFFAOYSA-N
MW160.24 g/mol
LogP0.19
Rot. Bonds6

About N-(5-amino-5-sulfanylidenepentyl)formamide

N-(5-amino-5-sulfanylidenepentyl)formamide (PubChem CID 64992008) has the molecular formula C6H12N2OS and a molecular weight of 160.24 g/mol. Its IUPAC name is N-(5-amino-5-sulfanylidenepentyl)formamide.

Molecular Properties

Compound NameN-(5-amino-5-sulfanylidenepentyl)formamide
PubChem CID64992008
Molecular FormulaC6H12N2OS
Molecular Weight160.24 g/mol
Exact Mass160.07
IUPAC NameN-(5-amino-5-sulfanylidenepentyl)formamide
SMILESNC(=S)CCCCNC=O
InChIInChI=1S/C6H12N2OS/c7-6(10)3-1-2-4-8-5-9/h5H,1-4H2,(H2,7,10)(H,8,9)
InChIKeyFLUNHDXEGFTBLE-UHFFFAOYSA-N
XLogP0.19
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

prop-2-enyl 6-formamidohexanoate
CID 12006461
propyl 7-formamidoheptanoate
CID 54319658
methane;N-(10-methyl-9-oxoundecyl)formamide
CID 176664599
4-formamidobutane-1-sulfonic acid
CID 87328027
N-(5-amino-5-sulfanylidenepentyl)-3,4-dihydroxybenzamide
CID 107728397
2,2-difluoroethyl 4-formamidobutanoate
CID 166769091
6-formamido-N-pentan-3-ylhexanamide
CID 177031400
N-pentacosylformamide
CID 88723962
ethane;N-pentylformamide
CID 145350301
N-[2-[2-(2-aminoethylamino)ethylamino]ethyl]formamide
CID 121459092
N-tetracosylformamide
CID 54077607
N-[3-(methylamino)propyl]formamide
CID 54313593

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-5-sulfanylidenepentyl)formamide?
The IUPAC name of N-(5-amino-5-sulfanylidenepentyl)formamide (CID 64992008) is N-(5-amino-5-sulfanylidenepentyl)formamide.
What is the SMILES notation for N-(5-amino-5-sulfanylidenepentyl)formamide?
The canonical SMILES for N-(5-amino-5-sulfanylidenepentyl)formamide is NC(=S)CCCCNC=O.
What is the InChIKey of N-(5-amino-5-sulfanylidenepentyl)formamide?
The InChIKey is FLUNHDXEGFTBLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2OS/c7-6(10)3-1-2-4-8-5-9/h5H,1-4H2,(H2,7,10)(H,8,9).
What are the key properties of N-(5-amino-5-sulfanylidenepentyl)formamide?
N-(5-amino-5-sulfanylidenepentyl)formamide has a molecular weight of 160.24 g/mol, XLogP of 0.19, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-5-sulfanylidenepentyl)formamide is sourced from PubChem (CID 64992008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).