4-methyl-N'-propan-2-ylpentanimidamide

C9H20N2 — CID 63181653

IUPAC4-methyl-N'-propan-2-ylpentanimidamide
SMILESCC(C)CC/C(N)=N\C(C)C
InChIInChI=1S/C9H20N2/c1-7(2)5-6-9(10)11-8(3)4/h7-8H,5-6H2,1-4H3,(H2,10,11)
InChIKeyGTZHZRANCJIPMY-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.19
Rot. Bonds4

About 4-methyl-N'-propan-2-ylpentanimidamide

4-methyl-N'-propan-2-ylpentanimidamide (PubChem CID 63181653) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 4-methyl-N'-propan-2-ylpentanimidamide.

Molecular Properties

Compound Name4-methyl-N'-propan-2-ylpentanimidamide
PubChem CID63181653
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name4-methyl-N'-propan-2-ylpentanimidamide
SMILESCC(C)CC/C(N)=N\C(C)C
InChIInChI=1S/C9H20N2/c1-7(2)5-6-9(10)11-8(3)4/h7-8H,5-6H2,1-4H3,(H2,10,11)
InChIKeyGTZHZRANCJIPMY-UHFFFAOYSA-N
XLogP2.19
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

3-[2-[bis[2-[(3-amino-3-propan-2-yliminopropyl)amino]ethyl]amino]ethylamino]-N'-propan-2-ylpropanimidamide
CID 165128044
5-methylhex-1-en-2-amine;molecular hydrogen
CID 142092760
3-amino-1,1-bis(3-methylbutyl)-2-propan-2-ylguanidine
CID 107871905
1-N',14-N'-bis(1-hydroxyethyl)tetradecanediimidamide
CID 141081453
5-methylhex-1-en-2-ylphosphane
CID 143105119
N'-(6-methylheptan-2-yl)propanimidamide
CID 63177540
ethane;2-(4-methylpentyl)guanidine
CID 170602256
3,4-dimethoxy-N'-propan-2-ylpyrrolidine-1-carboximidamide
CID 103534613
2,8-dimethyl-5-methylidenenonane
CID 545812
2-methylpropyl N'-propan-2-ylcarbamimidothioate;hydrochloride
CID 131224139
2,6-dimethylheptane;2,5-dimethylhexane;1,2-di(propan-2-yl)guanidine;1,3-di(propan-2-yl)urea
CID 159966773
N-(4-methyl-1-silylpentylidene)hydroxylamine
CID 174561312

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N'-propan-2-ylpentanimidamide?
The IUPAC name of 4-methyl-N'-propan-2-ylpentanimidamide (CID 63181653) is 4-methyl-N'-propan-2-ylpentanimidamide.
What is the SMILES notation for 4-methyl-N'-propan-2-ylpentanimidamide?
The canonical SMILES for 4-methyl-N'-propan-2-ylpentanimidamide is CC(C)CC/C(N)=N\C(C)C.
What is the InChIKey of 4-methyl-N'-propan-2-ylpentanimidamide?
The InChIKey is GTZHZRANCJIPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-7(2)5-6-9(10)11-8(3)4/h7-8H,5-6H2,1-4H3,(H2,10,11).
What are the key properties of 4-methyl-N'-propan-2-ylpentanimidamide?
4-methyl-N'-propan-2-ylpentanimidamide has a molecular weight of 156.27 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N'-propan-2-ylpentanimidamide is sourced from PubChem (CID 63181653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).