N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine

C10H18F2N2 — CID 130654103

IUPACN-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine
SMILESNC1(CNC2CCC(F)(F)C2)CCC1
InChIInChI=1S/C10H18F2N2/c11-10(12)5-2-8(6-10)14-7-9(13)3-1-4-9/h8,14H,1-7,13H2
InChIKeyBQOYSHLIWDGZMJ-UHFFFAOYSA-N
MW204.26 g/mol
LogP1.65
Rot. Bonds3

About N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine

N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine (PubChem CID 130654103) has the molecular formula C10H18F2N2 and a molecular weight of 204.26 g/mol. Its IUPAC name is N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine.

Molecular Properties

Compound NameN-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine
PubChem CID130654103
Molecular FormulaC10H18F2N2
Molecular Weight204.26 g/mol
Exact Mass204.14
IUPAC NameN-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine
SMILESNC1(CNC2CCC(F)(F)C2)CCC1
InChIInChI=1S/C10H18F2N2/c11-10(12)5-2-8(6-10)14-7-9(13)3-1-4-9/h8,14H,1-7,13H2
InChIKeyBQOYSHLIWDGZMJ-UHFFFAOYSA-N
XLogP1.65
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.26
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-difluoroethyl)-3,3-difluorocyclopentan-1-amine
CID 130831231
1-[[(3,3-dimethylcyclopentyl)amino]methyl]-3-methylcyclohexan-1-amine
CID 114547425
2-[(3,3-difluorocyclopentyl)amino]ethyl cyclopropanecarboxylate
CID 174623149
N-[(1-aminocyclohexyl)methyl]spiro[3.4]octan-3-amine
CID 128875139
N-(3,3-difluorocyclopentyl)aniline
CID 170406665
3-[(cyclopentylamino)methyl]oxolan-3-amine
CID 64893450
1-cyclopropyl-3-(3,3-difluorocyclopentyl)urea
CID 130609514
(1S)-3,3-difluoro-N-methylcyclohexan-1-amine
CID 177192029
3,3-difluoro-N-(1,2,5-thiadiazol-3-ylmethyl)cyclopentan-1-amine
CID 130857599
N-(3-ethylcyclobutyl)-3,3-difluorocyclopentan-1-amine
CID 126989380
1-[[(2-methylcyclopropyl)amino]methyl]cyclohexan-1-amine
CID 62409401
1-[2-(3,3-difluorocyclopentyl)ethyl]cyclopropan-1-amine
CID 105443651

Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine?
The IUPAC name of N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine (CID 130654103) is N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine.
What is the SMILES notation for N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine?
The canonical SMILES for N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine is NC1(CNC2CCC(F)(F)C2)CCC1.
What is the InChIKey of N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine?
The InChIKey is BQOYSHLIWDGZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2/c11-10(12)5-2-8(6-10)14-7-9(13)3-1-4-9/h8,14H,1-7,13H2.
What are the key properties of N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine?
N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine has a molecular weight of 204.26 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclobutyl)methyl]-3,3-difluorocyclopentan-1-amine is sourced from PubChem (CID 130654103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).