2-deuteriopropan-1-amine

C3H9N — CID 164969480

IUPAC2-deuteriopropan-1-amine
SMILES[2H]C(C)CN
InChIInChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3/i2D
InChIKeyWGYKZJWCGVVSQN-VMNATFBRSA-N
MW60.12 g/mol
LogP0.36
Rot. Bonds1

About 2-deuteriopropan-1-amine

2-deuteriopropan-1-amine (PubChem CID 164969480) has the molecular formula C3H9N and a molecular weight of 60.12 g/mol. Its IUPAC name is 2-deuteriopropan-1-amine.

Molecular Properties

Compound Name2-deuteriopropan-1-amine
PubChem CID164969480
Molecular FormulaC3H9N
Molecular Weight60.12 g/mol
Exact Mass60.08
IUPAC Name2-deuteriopropan-1-amine
SMILES[2H]C(C)CN
InChIInChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3/i2D
InChIKeyWGYKZJWCGVVSQN-VMNATFBRSA-N
XLogP0.36
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50060.12
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dideuterio-2-(1,1,2-trideuteriopropyldisulfanyl)ethanamine
CID 164996291
2-deuterio-2-(2-deuteriopropyldisulfanyl)ethanamine
CID 164969487
tetrakis(propan-1-amine);hydrochloride
CID 175147517
methanamine;propan-1-amine
CID 174401189
ethanamine;ethane;ethane-1,2-diamine
CID 144954036
2-deuteriononan-1-amine
CID 10820665
sodium;ethanamine;cyanide
CID 23663358
ethane;methanamine;bis(propan-1-amine)
CID 142026160
azane;propan-1-amine;hydrochloride
CID 141075684
ethanamine;ethane-1,2-diamine;ethene
CID 22315764
2-chloro-2,2-dideuterioethanamine
CID 10534652
ethanamine;ethane
CID 142339743

Frequently Asked Questions

What is the IUPAC name of 2-deuteriopropan-1-amine?
The IUPAC name of 2-deuteriopropan-1-amine (CID 164969480) is 2-deuteriopropan-1-amine.
What is the SMILES notation for 2-deuteriopropan-1-amine?
The canonical SMILES for 2-deuteriopropan-1-amine is [2H]C(C)CN.
What is the InChIKey of 2-deuteriopropan-1-amine?
The InChIKey is WGYKZJWCGVVSQN-VMNATFBRSA-N. The full InChI is InChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3/i2D.
What are the key properties of 2-deuteriopropan-1-amine?
2-deuteriopropan-1-amine has a molecular weight of 60.12 g/mol, XLogP of 0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-deuteriopropan-1-amine is sourced from PubChem (CID 164969480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).