(3R)-but-1-ene-2,3-diamine

C4H10N2 — CID 142167658

IUPAC(3R)-but-1-ene-2,3-diamine
SMILESC=C(N)[C@@H](C)N
InChIInChI=1S/C4H10N2/c1-3(5)4(2)6/h4H,1,5-6H2,2H3/t4-/m1/s1
InChIKeyBWXRHLNNMQNLQM-SCSAIBSYSA-N
MW86.14 g/mol
LogP-0.19
Rot. Bonds1

About (3R)-but-1-ene-2,3-diamine

(3R)-but-1-ene-2,3-diamine (PubChem CID 142167658) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is (3R)-but-1-ene-2,3-diamine.

Molecular Properties

Compound Name(3R)-but-1-ene-2,3-diamine
PubChem CID142167658
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Name(3R)-but-1-ene-2,3-diamine
SMILESC=C(N)[C@@H](C)N
InChIInChI=1S/C4H10N2/c1-3(5)4(2)6/h4H,1,5-6H2,2H3/t4-/m1/s1
InChIKeyBWXRHLNNMQNLQM-SCSAIBSYSA-N
XLogP-0.19
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,2-N-dimethylbut-1-ene-2,3-diamine
CID 123414251
ethane;propan-2-amine;prop-1-en-2-amine
CID 162282667
2-methylpropane;prop-1-en-2-amine
CID 174893746
1-iodoprop-2-ene-1,2-diamine
CID 126580837
(2R)-2-aminopropanethioamide
CID 55285662
(2R)-2-aminopropanoic acid;2-methylprop-2-enamide
CID 175865115
3-amino-2-methylbut-3-en-1-ol
CID 143544491
3-N,3-N-dimethylbut-1-ene-2,3-diamine
CID 89045153
2-aminopropanamide;2-methylprop-2-enoic acid;hydrochloride
CID 175162079
2-aminopropanamide;ethane
CID 156828005
2-aminopropanamide;dihydrochloride
CID 19963402
3-nitrosobut-1-en-2-amine
CID 143474262

Frequently Asked Questions

What is the IUPAC name of (3R)-but-1-ene-2,3-diamine?
The IUPAC name of (3R)-but-1-ene-2,3-diamine (CID 142167658) is (3R)-but-1-ene-2,3-diamine.
What is the SMILES notation for (3R)-but-1-ene-2,3-diamine?
The canonical SMILES for (3R)-but-1-ene-2,3-diamine is C=C(N)[C@@H](C)N.
What is the InChIKey of (3R)-but-1-ene-2,3-diamine?
The InChIKey is BWXRHLNNMQNLQM-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H10N2/c1-3(5)4(2)6/h4H,1,5-6H2,2H3/t4-/m1/s1.
What are the key properties of (3R)-but-1-ene-2,3-diamine?
(3R)-but-1-ene-2,3-diamine has a molecular weight of 86.14 g/mol, XLogP of -0.19, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-but-1-ene-2,3-diamine is sourced from PubChem (CID 142167658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).