N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine

C10H16ClNO — CID 103580782

IUPACN-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine
SMILESCl/C=C/CNC1CCOC1C1CC1
InChIInChI=1S/C10H16ClNO/c11-5-1-6-12-9-4-7-13-10(9)8-2-3-8/h1,5,8-10,12H,2-4,6-7H2/b5-1+
InChIKeyJHWNPDDSHXSOKJ-ORCRQEGFSA-N
MW201.70 g/mol
LogP1.90
Rot. Bonds4

About N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine

N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine (PubChem CID 103580782) has the molecular formula C10H16ClNO and a molecular weight of 201.70 g/mol. Its IUPAC name is N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine.

Molecular Properties

Compound NameN-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine
PubChem CID103580782
Molecular FormulaC10H16ClNO
Molecular Weight201.70 g/mol
Exact Mass201.09
IUPAC NameN-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine
SMILESCl/C=C/CNC1CCOC1C1CC1
InChIInChI=1S/C10H16ClNO/c11-5-1-6-12-9-4-7-13-10(9)8-2-3-8/h1,5,8-10,12H,2-4,6-7H2/b5-1+
InChIKeyJHWNPDDSHXSOKJ-ORCRQEGFSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.70
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-N-prop-2-enyloxolan-3-amine
CID 103580651
2-cyclopropyl-N-[(E)-2,3-dichloroprop-2-enyl]oxolan-3-amine
CID 103580684
N-but-3-en-2-yl-2-cyclopropyloxolan-3-amine
CID 103580728
N-[(E)-but-2-enyl]-2-cyclopropyloxolan-3-amine
CID 103580770
2-cyclopropyl-N-pent-4-enyloxolan-3-amine
CID 103580803
2-cyclopropyl-N-(2-methylprop-2-enyl)oxolan-3-amine
CID 103580813
2-cyclopropyl-N-(3-methylbut-2-enyl)oxolan-3-amine
CID 103580871
N-but-3-enyl-2-cyclopropyloxolan-3-amine
CID 103580872
2-cyclopropyl-N-hex-5-en-2-yloxolan-3-amine
CID 104583626
N-[(E)-4-chlorobut-2-enyl]-2-cyclopropyloxolan-3-amine
CID 105840173
N-(2-chloroprop-2-enyl)-2-cyclopropyloxolan-3-amine
CID 105840200
N-(3-chloro-2-methylprop-2-enyl)-2-cyclopropyloxolan-3-amine
CID 106438267

Frequently Asked Questions

What is the IUPAC name of N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine?
The IUPAC name of N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine (CID 103580782) is N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine.
What is the SMILES notation for N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine?
The canonical SMILES for N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine is Cl/C=C/CNC1CCOC1C1CC1.
What is the InChIKey of N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine?
The InChIKey is JHWNPDDSHXSOKJ-ORCRQEGFSA-N. The full InChI is InChI=1S/C10H16ClNO/c11-5-1-6-12-9-4-7-13-10(9)8-2-3-8/h1,5,8-10,12H,2-4,6-7H2/b5-1+.
What are the key properties of N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine?
N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine has a molecular weight of 201.70 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-3-chloroprop-2-enyl]-2-cyclopropyloxolan-3-amine is sourced from PubChem (CID 103580782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).