ethane;propan-2-amine;prop-1-en-2-amine

C8H22N2 — CID 162282667

IUPACethane;propan-2-amine;prop-1-en-2-amine
SMILESC=C(C)N.CC.CC(C)N
InChIInChI=1S/C3H9N.C3H7N.C2H6/c2*1-3(2)4;1-2/h3H,4H2,1-2H3;1,4H2,2H3;1-2H3
InChIKeyATTNCXUINOBQOE-UHFFFAOYSA-N
MW146.28 g/mol
LogP1.86
Rot. Bonds

About ethane;propan-2-amine;prop-1-en-2-amine

ethane;propan-2-amine;prop-1-en-2-amine (PubChem CID 162282667) has the molecular formula C8H22N2 and a molecular weight of 146.28 g/mol. Its IUPAC name is ethane;propan-2-amine;prop-1-en-2-amine.

Molecular Properties

Compound Nameethane;propan-2-amine;prop-1-en-2-amine
PubChem CID162282667
Molecular FormulaC8H22N2
Molecular Weight146.28 g/mol
Exact Mass146.18
IUPAC Nameethane;propan-2-amine;prop-1-en-2-amine
SMILESC=C(C)N.CC.CC(C)N
InChIInChI=1S/C3H9N.C3H7N.C2H6/c2*1-3(2)4;1-2/h3H,4H2,1-2H3;1,4H2,2H3;1-2H3
InChIKeyATTNCXUINOBQOE-UHFFFAOYSA-N
XLogP1.86
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.28
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylpropane;prop-1-en-2-amine
CID 174893746
ethane;2-methylbutane;prop-1-en-2-amine
CID 144735709
prop-1-en-2-amine;yttrium
CID 158882655
(3R)-but-1-ene-2,3-diamine
CID 142167658
(2R)-2-aminopropanoic acid;2-methylprop-2-enamide
CID 175865115
ethane;tris(2-methylprop-1-ene)
CID 144520420
hydron;propan-2-amine
CID 174699722
2,4,4-trimethylpent-1-en-3-amine
CID 15063448
4-aminopent-1-en-2-ol;ethane
CID 144955296
2-N,2-N-dimethylbut-1-ene-2,3-diamine
CID 123414251
4-amino-3-methylpent-1-en-2-ol;ethane
CID 144955322
ethane;(3S)-2,3,4,4-tetramethylpent-1-ene
CID 145347239

Frequently Asked Questions

What is the IUPAC name of ethane;propan-2-amine;prop-1-en-2-amine?
The IUPAC name of ethane;propan-2-amine;prop-1-en-2-amine (CID 162282667) is ethane;propan-2-amine;prop-1-en-2-amine.
What is the SMILES notation for ethane;propan-2-amine;prop-1-en-2-amine?
The canonical SMILES for ethane;propan-2-amine;prop-1-en-2-amine is C=C(C)N.CC.CC(C)N.
What is the InChIKey of ethane;propan-2-amine;prop-1-en-2-amine?
The InChIKey is ATTNCXUINOBQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.C3H7N.C2H6/c2*1-3(2)4;1-2/h3H,4H2,1-2H3;1,4H2,2H3;1-2H3.
What are the key properties of ethane;propan-2-amine;prop-1-en-2-amine?
ethane;propan-2-amine;prop-1-en-2-amine has a molecular weight of 146.28 g/mol, XLogP of 1.86, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propan-2-amine;prop-1-en-2-amine is sourced from PubChem (CID 162282667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).