N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine

C17H26FN3 — CID 106621639

IUPACN-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine
SMILESCCC(c1ccc(F)cn1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C17H26FN3/c1-2-17(16-9-6-13(18)11-20-16)21(15-7-8-15)12-14-5-3-4-10-19-14/h6,9,11,14-15,17,19H,2-5,7-8,10,12H2,1H3
InChIKeyLZPHTYWEQDEHPV-UHFFFAOYSA-N
MW291.41 g/mol
LogP3.28
Rot. Bonds6

About N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine

N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine (PubChem CID 106621639) has the molecular formula C17H26FN3 and a molecular weight of 291.41 g/mol. Its IUPAC name is N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine
PubChem CID106621639
Molecular FormulaC17H26FN3
Molecular Weight291.41 g/mol
Exact Mass291.21
IUPAC NameN-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine
SMILESCCC(c1ccc(F)cn1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C17H26FN3/c1-2-17(16-9-6-13(18)11-20-16)21(15-7-8-15)12-14-5-3-4-10-19-14/h6,9,11,14-15,17,19H,2-5,7-8,10,12H2,1H3
InChIKeyLZPHTYWEQDEHPV-UHFFFAOYSA-N
XLogP3.28
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.41
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-fluoro-2-pyridinyl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106603963
1-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)-N-propylpropan-1-amine
CID 106623207
N-[1-(4-methoxyphenyl)propyl]-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599038
2-(aminomethyl)-N-ethyl-N-[1-(5-fluoro-2-pyridinyl)propyl]cyclopentan-1-amine
CID 115940605
N-[1-(3-chlorophenyl)propyl]-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106598999
1-(4-fluorophenyl)-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106602815
N-(2-methoxy-1-phenylethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621863
N-pentan-2-yl-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621821
N-[1-(3,5-difluorophenyl)ethyl]-N-(pyrrolidin-2-ylmethyl)cyclopropanamine
CID 106599064
2-(azepan-2-yl)-1-(5-fluoro-2-pyridinyl)ethanone
CID 83120123
5-fluoro-N-methyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 71641981
N-cyclopropyl-2-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)acetamide
CID 106626819

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine?
The IUPAC name of N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine (CID 106621639) is N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine?
The canonical SMILES for N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine is CCC(c1ccc(F)cn1)N(CC1CCCCN1)C1CC1.
What is the InChIKey of N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine?
The InChIKey is LZPHTYWEQDEHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN3/c1-2-17(16-9-6-13(18)11-20-16)21(15-7-8-15)12-14-5-3-4-10-19-14/h6,9,11,14-15,17,19H,2-5,7-8,10,12H2,1H3.
What are the key properties of N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine?
N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine has a molecular weight of 291.41 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-fluoro-2-pyridinyl)propyl]-N-(piperidin-2-ylmethyl)cyclopropanamine is sourced from PubChem (CID 106621639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).