[ethylamino(methyl)amino]methanamine

C4H13N3 — CID 118974921

IUPAC[ethylamino(methyl)amino]methanamine
SMILESCCNN(C)CN
InChIInChI=1S/C4H13N3/c1-3-6-7(2)4-5/h6H,3-5H2,1-2H3
InChIKeyUSVLRGBGQZILTN-UHFFFAOYSA-N
MW103.17 g/mol
LogP-0.64
Rot. Bonds3

About [ethylamino(methyl)amino]methanamine

[ethylamino(methyl)amino]methanamine (PubChem CID 118974921) has the molecular formula C4H13N3 and a molecular weight of 103.17 g/mol. Its IUPAC name is [ethylamino(methyl)amino]methanamine.

Molecular Properties

Compound Name[ethylamino(methyl)amino]methanamine
PubChem CID118974921
Molecular FormulaC4H13N3
Molecular Weight103.17 g/mol
Exact Mass103.11
IUPAC Name[ethylamino(methyl)amino]methanamine
SMILESCCNN(C)CN
InChIInChI=1S/C4H13N3/c1-3-6-7(2)4-5/h6H,3-5H2,1-2H3
InChIKeyUSVLRGBGQZILTN-UHFFFAOYSA-N
XLogP-0.64
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 547943
CID 547943
CID 129014420
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CID 19027351
CID 19027351
CID 19438602
CID 19438602
CID 19736118
CID 19736118
CID 19898485
CID 19898485
CID 19957820
CID 19957820
CID 19974752
CID 19974752
CID 20451703
CID 20451703
CID 22460097
CID 22460097
CID 22712017
CID 22712017
CID 54377605
CID 54377605

Frequently Asked Questions

What is the IUPAC name of [ethylamino(methyl)amino]methanamine?
The IUPAC name of [ethylamino(methyl)amino]methanamine (CID 118974921) is [ethylamino(methyl)amino]methanamine.
What is the SMILES notation for [ethylamino(methyl)amino]methanamine?
The canonical SMILES for [ethylamino(methyl)amino]methanamine is CCNN(C)CN.
What is the InChIKey of [ethylamino(methyl)amino]methanamine?
The InChIKey is USVLRGBGQZILTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13N3/c1-3-6-7(2)4-5/h6H,3-5H2,1-2H3.
What are the key properties of [ethylamino(methyl)amino]methanamine?
[ethylamino(methyl)amino]methanamine has a molecular weight of 103.17 g/mol, XLogP of -0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethylamino(methyl)amino]methanamine is sourced from PubChem (CID 118974921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).