1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine

C7H14N2 — CID 163575227

IUPAC1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine
SMILESC=C[C@@](C)(N)C1(N)CC1
InChIInChI=1S/C7H14N2/c1-3-6(2,8)7(9)4-5-7/h3H,1,4-5,8-9H2,2H3/t6-/m1/s1
InChIKeyGCVZAAIKQYOTTQ-ZCFIWIBFSA-N
MW126.20 g/mol
LogP0.38
Rot. Bonds2

About 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine

1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine (PubChem CID 163575227) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine
PubChem CID163575227
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine
SMILESC=C[C@@](C)(N)C1(N)CC1
InChIInChI=1S/C7H14N2/c1-3-6(2,8)7(9)4-5-7/h3H,1,4-5,8-9H2,2H3/t6-/m1/s1
InChIKeyGCVZAAIKQYOTTQ-ZCFIWIBFSA-N
XLogP0.38
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N'-methylbut-3-ene-2,2-diamine
CID 123441192
3,3,4,4,5-pentamethylhex-1-ene
CID 23384855
(1Z)-3-methylpenta-1,4-diene-1,3-diamine
CID 143213661
4-(1,1-difluoroethyl)thian-4-amine
CID 84768507
3,3-dimethylbut-1-ene;2,2-dimethylpropane
CID 162278792
1,1-disilylprop-2-en-1-amine
CID 173457267
ethene;bis(2,2,5,5-tetramethylhex-3-ene)
CID 162279391
2-(1-aminocyclopentyl)propan-2-ol;hydrochloride
CID 67001422
2-ethenyl-2,4-dimethylpentan-1-amine
CID 102640269
sulfane;1-(trifluoromethyl)cyclopropan-1-amine
CID 159034051
(2S)-3-amino-3-methylpent-4-ene-2-sulfonamide
CID 143368080
3-methanidyl-3-methylbut-1-ene
CID 91253785

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine?
The IUPAC name of 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine (CID 163575227) is 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine is C=C[C@@](C)(N)C1(N)CC1.
What is the InChIKey of 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine?
The InChIKey is GCVZAAIKQYOTTQ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H14N2/c1-3-6(2,8)7(9)4-5-7/h3H,1,4-5,8-9H2,2H3/t6-/m1/s1.
What are the key properties of 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine?
1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine has a molecular weight of 126.20 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-aminobut-3-en-2-yl]cyclopropan-1-amine is sourced from PubChem (CID 163575227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).