N,N-bis(2,2-dimethylpropyl)nitrous amide

C10H22N2O — CID 87559088

IUPACN,N-bis(2,2-dimethylpropyl)nitrous amide
SMILESCC(C)(C)CN(CC(C)(C)C)N=O
InChIInChI=1S/C10H22N2O/c1-9(2,3)7-12(11-13)8-10(4,5)6/h7-8H2,1-6H3
InChIKeyBUBXJRNPWZGPJK-UHFFFAOYSA-N
MW186.30 g/mol
LogP3.06
Rot. Bonds3

About N,N-bis(2,2-dimethylpropyl)nitrous amide

N,N-bis(2,2-dimethylpropyl)nitrous amide (PubChem CID 87559088) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N,N-bis(2,2-dimethylpropyl)nitrous amide.

Molecular Properties

Compound NameN,N-bis(2,2-dimethylpropyl)nitrous amide
PubChem CID87559088
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN,N-bis(2,2-dimethylpropyl)nitrous amide
SMILESCC(C)(C)CN(CC(C)(C)C)N=O
InChIInChI=1S/C10H22N2O/c1-9(2,3)7-12(11-13)8-10(4,5)6/h7-8H2,1-6H3
InChIKeyBUBXJRNPWZGPJK-UHFFFAOYSA-N
XLogP3.06
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(2,2-dimethylpropyl)-N,N'-dimethylmethanediamine
CID 159238333
N-(chloromethyl)-N,2,2-trimethylpropan-1-amine
CID 115263125
iodo 2-[2,2-dimethylpropyl(methyl)amino]acetate
CID 139316007
methane;N,N,2,2-tetramethylpropan-1-amine
CID 160781651
lithium;hydride;N,N,2,2-tetramethylpropan-1-amine
CID 174663551
2-[2,2-dimethylpropyl(ethyl)amino]-2-methylpropanoic acid
CID 65061531
N-(2-iodoethyl)-N,2,2-trimethylpropan-1-amine
CID 130693540
1-N-(2,2-dimethylpropyl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 62846953
N-propyl-N-(3,3,3-trihydroxypropyl)nitrous amide
CID 140609588
3,3-dimethyl-1-nitrosobutane
CID 57089696
N,N-diethyl-2,2-dimethylpropan-1-amine;propane
CID 159791280
[2,2-dimethylpropyl(methyl)amino]methyl-trifluoroboranuide
CID 63702814

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2,2-dimethylpropyl)nitrous amide?
The IUPAC name of N,N-bis(2,2-dimethylpropyl)nitrous amide (CID 87559088) is N,N-bis(2,2-dimethylpropyl)nitrous amide.
What is the SMILES notation for N,N-bis(2,2-dimethylpropyl)nitrous amide?
The canonical SMILES for N,N-bis(2,2-dimethylpropyl)nitrous amide is CC(C)(C)CN(CC(C)(C)C)N=O.
What is the InChIKey of N,N-bis(2,2-dimethylpropyl)nitrous amide?
The InChIKey is BUBXJRNPWZGPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2,3)7-12(11-13)8-10(4,5)6/h7-8H2,1-6H3.
What are the key properties of N,N-bis(2,2-dimethylpropyl)nitrous amide?
N,N-bis(2,2-dimethylpropyl)nitrous amide has a molecular weight of 186.30 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2,2-dimethylpropyl)nitrous amide is sourced from PubChem (CID 87559088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).