5-methyl-2-nitroso-3-propan-2-ylhex-1-ene

C10H19NO — CID 167256004

IUPAC5-methyl-2-nitroso-3-propan-2-ylhex-1-ene
SMILESC=C(N=O)C(CC(C)C)C(C)C
InChIInChI=1S/C10H19NO/c1-7(2)6-10(8(3)4)9(5)11-12/h7-8,10H,5-6H2,1-4H3
InChIKeyNSIPPZPLFYPKCZ-UHFFFAOYSA-N
MW169.27 g/mol
LogP3.58
Rot. Bonds5

About 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene

5-methyl-2-nitroso-3-propan-2-ylhex-1-ene (PubChem CID 167256004) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene.

Molecular Properties

Compound Name5-methyl-2-nitroso-3-propan-2-ylhex-1-ene
PubChem CID167256004
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name5-methyl-2-nitroso-3-propan-2-ylhex-1-ene
SMILESC=C(N=O)C(CC(C)C)C(C)C
InChIInChI=1S/C10H19NO/c1-7(2)6-10(8(3)4)9(5)11-12/h7-8,10H,5-6H2,1-4H3
InChIKeyNSIPPZPLFYPKCZ-UHFFFAOYSA-N
XLogP3.58
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,7-dimethyl-5-propan-2-yloctan-4-one
CID 140579631
2,4-dimethyl-1-nitrosopentane
CID 143544578
(3R)-5-methyl-1-nitroso-3-propan-2-ylhexane
CID 173492968
(2S,4R,5R)-4,5,7-trimethyl-2-propan-2-yloctanoic acid
CID 56628753
N-(2-aminoethyl)-4-methyl-2-propan-2-ylpentanamide
CID 118593084
3-(1-hydroxyethyl)-5-methylhexan-2-one
CID 130027593
3-ethyl-2,6-dimethyl-4-propan-2-ylhept-1-ene
CID 123194726
methane;2-methyl-2-[(5-methyl-3-propan-2-ylhex-1-en-2-yl)amino]propane-1-sulfonic acid;4-methyl-2-propan-2-ylpentanoic acid
CID 163477693
2,4-dimethylpentane
CID 157050020
(3S)-N,2,5-trimethylhex-1-en-3-amine
CID 88572418
diethyl (2R,3R)-2,3-bis(2-methylpropyl)butanedioate
CID 100932305
4-methylpentan-2-yl 2-(aminomethyl)-3-methylbutanoate
CID 65220441

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene?
The IUPAC name of 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene (CID 167256004) is 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene.
What is the SMILES notation for 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene?
The canonical SMILES for 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene is C=C(N=O)C(CC(C)C)C(C)C.
What is the InChIKey of 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene?
The InChIKey is NSIPPZPLFYPKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)6-10(8(3)4)9(5)11-12/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene?
5-methyl-2-nitroso-3-propan-2-ylhex-1-ene has a molecular weight of 169.27 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-nitroso-3-propan-2-ylhex-1-ene is sourced from PubChem (CID 167256004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).