(Z)-amino-[amino(cyclopropyl)methylidene]azanium

C4H10N3+ — CID 138402621

IUPAC(Z)-amino-[amino(cyclopropyl)methylidene]azanium
SMILESN/[NH+]=C(\N)C1CC1
InChIInChI=1S/C4H9N3/c5-4(7-6)3-1-2-3/h3H,1-2,6H2,(H2,5,7)/p+1
InChIKeyNRNOONVPBHULFC-UHFFFAOYSA-O
MW100.14 g/mol
LogP-2.29
Rot. Bonds1

About (Z)-amino-[amino(cyclopropyl)methylidene]azanium

(Z)-amino-[amino(cyclopropyl)methylidene]azanium (PubChem CID 138402621) has the molecular formula C4H10N3+ and a molecular weight of 100.14 g/mol. Its IUPAC name is (Z)-amino-[amino(cyclopropyl)methylidene]azanium.

Molecular Properties

Compound Name(Z)-amino-[amino(cyclopropyl)methylidene]azanium
PubChem CID138402621
Molecular FormulaC4H10N3+
Molecular Weight100.14 g/mol
Exact Mass100.09
IUPAC Name(Z)-amino-[amino(cyclopropyl)methylidene]azanium
SMILESN/[NH+]=C(\N)C1CC1
InChIInChI=1S/C4H9N3/c5-4(7-6)3-1-2-3/h3H,1-2,6H2,(H2,5,7)/p+1
InChIKeyNRNOONVPBHULFC-UHFFFAOYSA-O
XLogP-2.29
TPSA66.01 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.14
LogP ≤ 5-2.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-hydroxycyclopropanecarboximidamide;hydrochloride
CID 53395019
cyclohexane;cyclohexane-1,4-dicarboxamide
CID 70276765
2-(1-cyclopropylethylideneamino)guanidine
CID 4581755
N'-aminocyclopropanecarboximidamide;hydrochloride
CID 13117503
methyl 4-fluorocyclohexane-1-carboxylate
CID 21281592
4-ethylcyclohexane-1-carbothioamide
CID 64749084
cyclopropanecarboxamide;formic acid
CID 161444896
cyclopropanecarboxamide;propanamide
CID 174752815
4-sulfanylcyclohexane-1-carboxamide
CID 45084548
4-bromocyclohexane-1-carbothioamide
CID 139541585
4-aminocyclohexane-1-carboxamide;dihydrochloride
CID 89303150
4-iodocyclohexane-1-carboxamide
CID 89050662

Frequently Asked Questions

What is the IUPAC name of (Z)-amino-[amino(cyclopropyl)methylidene]azanium?
The IUPAC name of (Z)-amino-[amino(cyclopropyl)methylidene]azanium (CID 138402621) is (Z)-amino-[amino(cyclopropyl)methylidene]azanium.
What is the SMILES notation for (Z)-amino-[amino(cyclopropyl)methylidene]azanium?
The canonical SMILES for (Z)-amino-[amino(cyclopropyl)methylidene]azanium is N/[NH+]=C(\N)C1CC1.
What is the InChIKey of (Z)-amino-[amino(cyclopropyl)methylidene]azanium?
The InChIKey is NRNOONVPBHULFC-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H9N3/c5-4(7-6)3-1-2-3/h3H,1-2,6H2,(H2,5,7)/p+1.
What are the key properties of (Z)-amino-[amino(cyclopropyl)methylidene]azanium?
(Z)-amino-[amino(cyclopropyl)methylidene]azanium has a molecular weight of 100.14 g/mol, XLogP of -2.29, 1 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-amino-[amino(cyclopropyl)methylidene]azanium is sourced from PubChem (CID 138402621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).