N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine

C16H26N4 — CID 62279976

IUPACN-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
SMILESCCCN1CCN(c2cc(CNC3CC3)ccn2)CC1
InChIInChI=1S/C16H26N4/c1-2-7-19-8-10-20(11-9-19)16-12-14(5-6-17-16)13-18-15-3-4-15/h5-6,12,15,18H,2-4,7-11,13H2,1H3
InChIKeyFAMHZGJOECDRBD-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.87
Rot. Bonds6

About N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine

N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine (PubChem CID 62279976) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
PubChem CID62279976
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
SMILESCCCN1CCN(c2cc(CNC3CC3)ccn2)CC1
InChIInChI=1S/C16H26N4/c1-2-7-19-8-10-20(11-9-19)16-12-14(5-6-17-16)13-18-15-3-4-15/h5-6,12,15,18H,2-4,7-11,13H2,1H3
InChIKeyFAMHZGJOECDRBD-UHFFFAOYSA-N
XLogP1.87
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(4-propan-2-ylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 62283972
N-[[3-fluoro-4-(4-propylpiperazin-1-yl)phenyl]methyl]cyclopropanamine
CID 43281201
N-[[2-(3,4-dimethoxypyrrolidin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 103539475
N-[[3-fluoro-2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105388892
N-[[2-[3-(methoxymethyl)piperidin-1-yl]-4-pyridinyl]methyl]cyclopropanamine
CID 106589213
2-methyl-1-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-3-(1-propylpiperidin-4-yl)guanidine;hydroiodide
CID 111016766
N-[[4-[(4-propylpiperazin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 62423801
1-propyl-N-(quinolin-6-ylmethyl)piperidin-4-amine
CID 60664069
4-propyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]cyclohexan-1-amine
CID 78871623
1-methyl-4-(4-propyl-2-pyridinyl)piperazine
CID 145392081
N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propan-1-amine
CID 62285745
N-[[2-(4-propylpiperidin-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 62285719

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine (CID 62279976) is N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine is CCCN1CCN(c2cc(CNC3CC3)ccn2)CC1.
What is the InChIKey of N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine?
The InChIKey is FAMHZGJOECDRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-2-7-19-8-10-20(11-9-19)16-12-14(5-6-17-16)13-18-15-3-4-15/h5-6,12,15,18H,2-4,7-11,13H2,1H3.
What are the key properties of N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine?
N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine has a molecular weight of 274.41 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 62279976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).