[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide

C9H20N4-2 — CID 163709035

IUPAC[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide
SMILESCC1CCC(C(C)N([NH-])N(C)[NH-])C1
InChIInChI=1S/C9H20N4/c1-7-4-5-9(6-7)8(2)13(11)12(3)10/h7-11H,4-6H2,1-3H3/q-2
InChIKeyXZSIYQAHNFNDGD-UHFFFAOYSA-N
MW184.29 g/mol
LogP2.89
Rot. Bonds3

About [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide

[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide (PubChem CID 163709035) has the molecular formula C9H20N4-2 and a molecular weight of 184.29 g/mol. Its IUPAC name is [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide.

Molecular Properties

Compound Name[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide
PubChem CID163709035
Molecular FormulaC9H20N4-2
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC Name[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide
SMILESCC1CCC(C(C)N([NH-])N(C)[NH-])C1
InChIInChI=1S/C9H20N4/c1-7-4-5-9(6-7)8(2)13(11)12(3)10/h7-11H,4-6H2,1-3H3/q-2
InChIKeyXZSIYQAHNFNDGD-UHFFFAOYSA-N
XLogP2.89
TPSA54.08 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-[1-(3-methylcyclopentyl)ethyl]propan-2-amine
CID 90905067
N,N-dimethyl-1-(4-methylcyclohexyl)ethanamine
CID 138474859
cis-(1S,3R)-1-methyl-3-propan-2-ylcyclopentane;ethane;hydrofluoride
CID 169140803
1-(3-methylcyclopentyl)ethanol
CID 12501270
1-cyclopropyl-N,N-dimethylethanamine
CID 10129924
[(1R,3S)-3-methylcyclopentyl]methanediol
CID 163440646
[2-methyl-1-(3-methylcyclopentyl)propyl]hydrazine
CID 105233167
2-(3-methylcyclopentyl)propan-1-ol
CID 14039414
4-N-methyl-3-(3-methylcyclopentyl)pentane-2,4-diamine
CID 166734994
1-methyl-3-propan-2-ylcyclopentane;3-propan-2-ylcyclobutan-1-ol
CID 158535526
5-methyl-1-(3-methylcyclopentyl)hexan-1-ol
CID 83161755
2-fluoro-4-methyl-1-propan-2-yloxycyclohexane
CID 129120859

Frequently Asked Questions

What is the IUPAC name of [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide?
The IUPAC name of [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide (CID 163709035) is [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide.
What is the SMILES notation for [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide?
The canonical SMILES for [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide is CC1CCC(C(C)N([NH-])N(C)[NH-])C1.
What is the InChIKey of [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide?
The InChIKey is XZSIYQAHNFNDGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4/c1-7-4-5-9(6-7)8(2)13(11)12(3)10/h7-11H,4-6H2,1-3H3/q-2.
What are the key properties of [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide?
[[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide has a molecular weight of 184.29 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[azanidyl(methyl)amino]-[1-(3-methylcyclopentyl)ethyl]amino]azanide is sourced from PubChem (CID 163709035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).