(2R)-3-N-methylpropane-1,2,3-triamine

C4H13N3 — CID 155906228

IUPAC(2R)-3-N-methylpropane-1,2,3-triamine
SMILESCNC[C@H](N)CN
InChIInChI=1S/C4H13N3/c1-7-3-4(6)2-5/h4,7H,2-3,5-6H2,1H3/t4-/m1/s1
InChIKeyCANSVBFJDVVCTO-SCSAIBSYSA-N
MW103.17 g/mol
LogP-1.51
Rot. Bonds3

About (2R)-3-N-methylpropane-1,2,3-triamine

(2R)-3-N-methylpropane-1,2,3-triamine (PubChem CID 155906228) has the molecular formula C4H13N3 and a molecular weight of 103.17 g/mol. Its IUPAC name is (2R)-3-N-methylpropane-1,2,3-triamine.

Molecular Properties

Compound Name(2R)-3-N-methylpropane-1,2,3-triamine
PubChem CID155906228
Molecular FormulaC4H13N3
Molecular Weight103.17 g/mol
Exact Mass103.11
IUPAC Name(2R)-3-N-methylpropane-1,2,3-triamine
SMILESCNC[C@H](N)CN
InChIInChI=1S/C4H13N3/c1-7-3-4(6)2-5/h4,7H,2-3,5-6H2,1H3/t4-/m1/s1
InChIKeyCANSVBFJDVVCTO-SCSAIBSYSA-N
XLogP-1.51
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-1-N-methylpropane-1,2-diamine
CID 89240852
butane-1,2-diamine;N,N'-dimethylethane-1,2-diamine
CID 87410830
(2S)-1-N-methylhexane-1,2-diamine
CID 89357717
1-N,6-dimethylheptane-1,2,5-triamine
CID 142425880
2-(1-fluoroethyl)-N'-methylpropane-1,3-diamine
CID 142196166
2-methoxy-N'-methylpropane-1,3-diamine
CID 20763150
ethane;2-ethyl-N'-methylpropane-1,3-diamine
CID 144511427
N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
CID 84716612
4-amino-2-methyl-5-(methylamino)pentanoic acid
CID 142843506
(2R)-1-N-methyl-3-phenylpropane-1,2-diamine
CID 54262187
N,2-dimethylpropan-1-amine;methanamine
CID 144585140
2-amino-3-(methylamino)propanenitrile
CID 59279770

Frequently Asked Questions

What is the IUPAC name of (2R)-3-N-methylpropane-1,2,3-triamine?
The IUPAC name of (2R)-3-N-methylpropane-1,2,3-triamine (CID 155906228) is (2R)-3-N-methylpropane-1,2,3-triamine.
What is the SMILES notation for (2R)-3-N-methylpropane-1,2,3-triamine?
The canonical SMILES for (2R)-3-N-methylpropane-1,2,3-triamine is CNC[C@H](N)CN.
What is the InChIKey of (2R)-3-N-methylpropane-1,2,3-triamine?
The InChIKey is CANSVBFJDVVCTO-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H13N3/c1-7-3-4(6)2-5/h4,7H,2-3,5-6H2,1H3/t4-/m1/s1.
What are the key properties of (2R)-3-N-methylpropane-1,2,3-triamine?
(2R)-3-N-methylpropane-1,2,3-triamine has a molecular weight of 103.17 g/mol, XLogP of -1.51, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-N-methylpropane-1,2,3-triamine is sourced from PubChem (CID 155906228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).