N-amino-N-methylpropanimidamide

C4H11N3 — CID 123454598

IUPACN-amino-N-methylpropanimidamide
SMILES[H]/N=C(\CC)N(C)N
InChIInChI=1S/C4H11N3/c1-3-4(5)7(2)6/h5H,3,6H2,1-2H3/b5-4+
InChIKeyKQMGWOQGLBSNSF-SNAWJCMRSA-N
MW101.15 g/mol
LogP0.18
Rot. Bonds1

About N-amino-N-methylpropanimidamide

N-amino-N-methylpropanimidamide (PubChem CID 123454598) has the molecular formula C4H11N3 and a molecular weight of 101.15 g/mol. Its IUPAC name is N-amino-N-methylpropanimidamide.

Molecular Properties

Compound NameN-amino-N-methylpropanimidamide
PubChem CID123454598
Molecular FormulaC4H11N3
Molecular Weight101.15 g/mol
Exact Mass101.10
IUPAC NameN-amino-N-methylpropanimidamide
SMILES[H]/N=C(\CC)N(C)N
InChIInChI=1S/C4H11N3/c1-3-4(5)7(2)6/h5H,3,6H2,1-2H3/b5-4+
InChIKeyKQMGWOQGLBSNSF-SNAWJCMRSA-N
XLogP0.18
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-methyl-N-propylpropanimidamide
CID 63176074
N-(2,2-dimethylpropyl)-N-methylpropanimidamide
CID 63177754
N-[(Z)-but-2-en-2-yl]-N-methylpropanimidamide
CID 135276889
N-methyl-N-prop-2-ynylpropanimidamide
CID 143160706
N-[2-(dimethylamino)ethyl]-N-propylpropanimidamide
CID 63177323
N,N-dimethyl-2-[methyl(propanimidoyl)amino]acetamide
CID 146735988
N-methyl-N-[3-(methylamino)propyl]propanimidamide
CID 87549397
CID 15722406
CID 15722406
N-methyl-N-(1-methylpiperidin-4-yl)propanimidamide
CID 63178577
3-N,3-N-dimethylpropanediimidamide
CID 58160656
N-ethyl-N-(methyliminomethyl)propanimidamide
CID 131979243
N-ethenyl-N-propan-2-ylpropanimidamide
CID 146638834

Frequently Asked Questions

What is the IUPAC name of N-amino-N-methylpropanimidamide?
The IUPAC name of N-amino-N-methylpropanimidamide (CID 123454598) is N-amino-N-methylpropanimidamide.
What is the SMILES notation for N-amino-N-methylpropanimidamide?
The canonical SMILES for N-amino-N-methylpropanimidamide is [H]/N=C(\CC)N(C)N.
What is the InChIKey of N-amino-N-methylpropanimidamide?
The InChIKey is KQMGWOQGLBSNSF-SNAWJCMRSA-N. The full InChI is InChI=1S/C4H11N3/c1-3-4(5)7(2)6/h5H,3,6H2,1-2H3/b5-4+.
What are the key properties of N-amino-N-methylpropanimidamide?
N-amino-N-methylpropanimidamide has a molecular weight of 101.15 g/mol, XLogP of 0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-methylpropanimidamide is sourced from PubChem (CID 123454598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).