2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine

C8H21N3 — CID 103390735

IUPAC2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine
SMILESCC(CN)NC(C)CN(C)C
InChIInChI=1S/C8H21N3/c1-7(5-9)10-8(2)6-11(3)4/h7-8,10H,5-6,9H2,1-4H3
InChIKeyFOXBBQIMQQBHPV-UHFFFAOYSA-N
MW159.28 g/mol
LogP-0.13
Rot. Bonds5

About 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine

2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine (PubChem CID 103390735) has the molecular formula C8H21N3 and a molecular weight of 159.28 g/mol. Its IUPAC name is 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine.

Molecular Properties

Compound Name2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine
PubChem CID103390735
Molecular FormulaC8H21N3
Molecular Weight159.28 g/mol
Exact Mass159.17
IUPAC Name2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine
SMILESCC(CN)NC(C)CN(C)C
InChIInChI=1S/C8H21N3/c1-7(5-9)10-8(2)6-11(3)4/h7-8,10H,5-6,9H2,1-4H3
InChIKeyFOXBBQIMQQBHPV-UHFFFAOYSA-N
XLogP-0.13
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.28
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[1-[benzyl(methyl)amino]propan-2-yl]propane-1,2-diamine
CID 130563657
2-N-(4-methoxy-4-methylpentan-2-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82945735
N'-[1-(dimethylamino)propan-2-yl]-2-propan-2-ylpropane-1,3-diamine
CID 107442614
2-N-(dicyclopropylmethyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82946340
2-N-(3-methylbutan-2-yl)propane-1,2-diamine
CID 103387734
2-N-(1-ethoxypropan-2-yl)propane-1,2-diamine
CID 103389655
2-N-ethyl-1-N,1-N-dimethylpropane-1,2-diamine
CID 23008779
3-[1-(dimethylamino)propan-2-ylamino]-N'-hydroxypentanimidamide
CID 82938574
1-N,1-N-dimethyl-2-N-(1-pyrrolidin-2-ylpropan-2-yl)propane-1,2-diamine
CID 82937432
2-N-but-3-yn-2-ylpropane-1,2-diamine
CID 114415976
ethane;2-N,3-N,3-N-trimethylpropane-1,2,3-triamine
CID 164903776
(2R)-1-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
CID 106932409

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine?
The IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine (CID 103390735) is 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine.
What is the SMILES notation for 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine?
The canonical SMILES for 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine is CC(CN)NC(C)CN(C)C.
What is the InChIKey of 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine?
The InChIKey is FOXBBQIMQQBHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3/c1-7(5-9)10-8(2)6-11(3)4/h7-8,10H,5-6,9H2,1-4H3.
What are the key properties of 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine?
2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine has a molecular weight of 159.28 g/mol, XLogP of -0.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(dimethylamino)propan-2-yl]propane-1,2-diamine is sourced from PubChem (CID 103390735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).