N-[5-(dimethylamino)pentan-2-yl]formamide

C8H18N2O — CID 141096564

IUPACN-[5-(dimethylamino)pentan-2-yl]formamide
SMILESCC(CCCN(C)C)NC=O
InChIInChI=1S/C8H18N2O/c1-8(9-7-11)5-4-6-10(2)3/h7-8H,4-6H2,1-3H3,(H,9,11)
InChIKeyYOQUGEITWSQPIR-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.46
Rot. Bonds6

About N-[5-(dimethylamino)pentan-2-yl]formamide

N-[5-(dimethylamino)pentan-2-yl]formamide (PubChem CID 141096564) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is N-[5-(dimethylamino)pentan-2-yl]formamide.

Molecular Properties

Compound NameN-[5-(dimethylamino)pentan-2-yl]formamide
PubChem CID141096564
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameN-[5-(dimethylamino)pentan-2-yl]formamide
SMILESCC(CCCN(C)C)NC=O
InChIInChI=1S/C8H18N2O/c1-8(9-7-11)5-4-6-10(2)3/h7-8H,4-6H2,1-3H3,(H,9,11)
InChIKeyYOQUGEITWSQPIR-UHFFFAOYSA-N
XLogP0.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(2R)-octan-2-yl]formamide
CID 5478865
N-(5-formamidohexyl)formamide
CID 154679922
N-(4-formamidopentan-2-yl)formamide
CID 174912100
N-[(2S)-4-(butylamino)butan-2-yl]formamide
CID 143293736
4-[3-(dimethylamino)propyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 58251491
N-(1-sulfanylpropan-2-yl)formamide
CID 165129664
N-(1-bromopropan-2-yl)formamide
CID 57167291
(E)-3-[4-(dimethylamino)butan-2-ylamino]prop-2-enoic acid
CID 103246575
(E)-3-[5-(diethylamino)pentan-2-ylamino]prop-2-enoic acid
CID 103233776
5-(dimethylamino)-N,2-dimethylpentanamide
CID 123779216
N-[5-(dimethylamino)pentan-2-yl]-3-ethylsulfanyl-2-methylpropanamide
CID 91058141
1-N-[2-(dimethylamino)ethyl]-4-N-ethyl-1-N-methylpentane-1,4-diamine
CID 63693980

Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylamino)pentan-2-yl]formamide?
The IUPAC name of N-[5-(dimethylamino)pentan-2-yl]formamide (CID 141096564) is N-[5-(dimethylamino)pentan-2-yl]formamide.
What is the SMILES notation for N-[5-(dimethylamino)pentan-2-yl]formamide?
The canonical SMILES for N-[5-(dimethylamino)pentan-2-yl]formamide is CC(CCCN(C)C)NC=O.
What is the InChIKey of N-[5-(dimethylamino)pentan-2-yl]formamide?
The InChIKey is YOQUGEITWSQPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-8(9-7-11)5-4-6-10(2)3/h7-8H,4-6H2,1-3H3,(H,9,11).
What are the key properties of N-[5-(dimethylamino)pentan-2-yl]formamide?
N-[5-(dimethylamino)pentan-2-yl]formamide has a molecular weight of 158.24 g/mol, XLogP of 0.46, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylamino)pentan-2-yl]formamide is sourced from PubChem (CID 141096564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).