1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine

C10H19F2NO — CID 103082710

IUPAC1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine
SMILESCCC(NCCOCC(F)F)C1CC1
InChIInChI=1S/C10H19F2NO/c1-2-9(8-3-4-8)13-5-6-14-7-10(11)12/h8-10,13H,2-7H2,1H3
InChIKeyYWWQZERNIBBLPW-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.05
Rot. Bonds8

About 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine

1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine (PubChem CID 103082710) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine
PubChem CID103082710
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine
SMILESCCC(NCCOCC(F)F)C1CC1
InChIInChI=1S/C10H19F2NO/c1-2-9(8-3-4-8)13-5-6-14-7-10(11)12/h8-10,13H,2-7H2,1H3
InChIKeyYWWQZERNIBBLPW-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,6,6,6-hexafluoro-N-(1-methoxypropan-2-yl)-3-methylhexan-3-amine
CID 117840547
N-(dicyclopropylmethyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 54961717
6-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]heptan-2-amine
CID 54962012
1-N,1-N,4-trimethyl-2-N-[2-(2,2,2-trifluoroethoxy)ethyl]pentane-1,2-diamine
CID 54963578
2-N-(1-cyclopropylethyl)-3,3,3-trifluoro-2-N-(2-methoxyethyl)propane-1,2-diamine
CID 55004003
3-N-(1-cyclopropylethyl)-4,4,4-trifluoro-3-N-(2-methoxyethyl)butane-1,3-diamine
CID 55004198
4-methyl-N-[2-(2,2,3,3-tetrafluoropropoxy)ethyl]pentan-1-amine
CID 55092870
5-methyl-N-[2-(2,2,3,3-tetrafluoropropoxy)ethyl]hexan-2-amine
CID 55092962
2-ethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]butan-1-amine
CID 60732572
2-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 60733194
3-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 60733195
3-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]butan-1-amine
CID 60733355

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine (CID 103082710) is 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine is CCC(NCCOCC(F)F)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine?
The InChIKey is YWWQZERNIBBLPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-2-9(8-3-4-8)13-5-6-14-7-10(11)12/h8-10,13H,2-7H2,1H3.
What are the key properties of 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine?
1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine has a molecular weight of 207.26 g/mol, XLogP of 2.05, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]propan-1-amine is sourced from PubChem (CID 103082710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).