N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine

C13H27N3 — CID 62557293

IUPACN-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
SMILESCC(CNC1CCCC1)N1CCN(C)CC1
InChIInChI=1S/C13H27N3/c1-12(11-14-13-5-3-4-6-13)16-9-7-15(2)8-10-16/h12-14H,3-11H2,1-2H3
InChIKeyZFMYSSXJFVLRHX-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.15
Rot. Bonds4

About N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine

N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine (PubChem CID 62557293) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
PubChem CID62557293
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
SMILESCC(CNC1CCCC1)N1CCN(C)CC1
InChIInChI=1S/C13H27N3/c1-12(11-14-13-5-3-4-6-13)16-9-7-15(2)8-10-16/h12-14H,3-11H2,1-2H3
InChIKeyZFMYSSXJFVLRHX-UHFFFAOYSA-N
XLogP1.15
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methylpiperazin-1-yl)propyl]cyclohexanamine
CID 62557467
N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]cyclopentanamine
CID 62568806
N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]cyclohexanamine
CID 62568807
N-(2-piperidin-1-ylpropyl)cyclopropanamine
CID 62424338
N-[2-(3,4,5-trimethylpiperazin-1-yl)propyl]cyclopentanamine
CID 114540357
N-[2-(4-methylazepan-1-yl)propyl]cyclohexanamine
CID 63627376
N-[2-(3-ethyl-4-methylpiperazin-1-yl)propyl]cyclopentanamine
CID 63621875
N-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propyl]cyclopentanamine
CID 63009402
N-[2-(4-cyclopropylpiperazin-1-yl)propyl]cyclopropanamine
CID 62411356
N-[2-(4-propan-2-ylpiperidin-1-yl)propyl]cyclopropanamine
CID 103503204
N-[2-(4-tert-butylpiperazin-1-yl)propyl]cyclopropanamine
CID 55072104

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine?
The IUPAC name of N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine (CID 62557293) is N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine.
What is the SMILES notation for N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine?
The canonical SMILES for N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine is CC(CNC1CCCC1)N1CCN(C)CC1.
What is the InChIKey of N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine?
The InChIKey is ZFMYSSXJFVLRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-12(11-14-13-5-3-4-6-13)16-9-7-15(2)8-10-16/h12-14H,3-11H2,1-2H3.
What are the key properties of N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine?
N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine has a molecular weight of 225.38 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine is sourced from PubChem (CID 62557293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).