N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine

C14H29N3 — CID 62418577

IUPACN-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine
SMILESCCN1CCN(C(C)CCCNC2CC2)CC1
InChIInChI=1S/C14H29N3/c1-3-16-9-11-17(12-10-16)13(2)5-4-8-15-14-6-7-14/h13-15H,3-12H2,1-2H3
InChIKeySLSABUQNBTZLOH-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds7

About N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine

N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine (PubChem CID 62418577) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine
PubChem CID62418577
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine
SMILESCCN1CCN(C(C)CCCNC2CC2)CC1
InChIInChI=1S/C14H29N3/c1-3-16-9-11-17(12-10-16)13(2)5-4-8-15-14-6-7-14/h13-15H,3-12H2,1-2H3
InChIKeySLSABUQNBTZLOH-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
CID 56828316
N-[4-(4,4-diethylpiperidin-1-yl)pentyl]cyclopropanamine
CID 63163241
N-[4-(4-methylazepan-1-yl)pentyl]cyclopropanamine
CID 55249022
1-N-cyclopropyl-4-N-(1-ethylpiperidin-4-yl)-4-N-methylpentane-1,4-diamine
CID 62436358
N-[4-(3-azaspiro[5.5]undecan-3-yl)pentyl]cyclopropanamine
CID 62930303
N-[4-(3-methylpiperidin-1-yl)pentyl]cyclopropanamine
CID 62437779
N-[4-(2,2,6,6-tetramethylmorpholin-4-yl)pentyl]cyclopropanamine
CID 102746064
1-N-cyclopropyl-4-N,4-N-dimethylpentane-1,4-diamine
CID 62418784
N-[3-(4-ethyl-3-methylpiperazin-1-yl)butyl]cyclopropanamine
CID 55215454
N,N'-dicyclopropyl-4-methylheptane-1,7-diamine
CID 66322125
N-[3-(4-benzylpiperazin-1-yl)butyl]cyclopropanamine
CID 62425638
N-(4-methylhexyl)cyclopropanamine
CID 62529631

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine?
The IUPAC name of N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine (CID 62418577) is N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine.
What is the SMILES notation for N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine?
The canonical SMILES for N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine is CCN1CCN(C(C)CCCNC2CC2)CC1.
What is the InChIKey of N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine?
The InChIKey is SLSABUQNBTZLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-3-16-9-11-17(12-10-16)13(2)5-4-8-15-14-6-7-14/h13-15H,3-12H2,1-2H3.
What are the key properties of N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine?
N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-ethylpiperazin-1-yl)pentyl]cyclopropanamine is sourced from PubChem (CID 62418577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).