N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine

C15H33N3 — CID 62776170

IUPACN-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine
SMILESCCCC(C)NCCN1CCN(CC(C)C)CC1
InChIInChI=1S/C15H33N3/c1-5-6-15(4)16-7-8-17-9-11-18(12-10-17)13-14(2)3/h14-16H,5-13H2,1-4H3
InChIKeyBJDDWSLCICBJAI-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.04
Rot. Bonds8

About N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine

N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine (PubChem CID 62776170) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine.

Molecular Properties

Compound NameN-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine
PubChem CID62776170
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine
SMILESCCCC(C)NCCN1CCN(CC(C)C)CC1
InChIInChI=1S/C15H33N3/c1-5-6-15(4)16-7-8-17-9-11-18(12-10-17)13-14(2)3/h14-16H,5-13H2,1-4H3
InChIKeyBJDDWSLCICBJAI-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-butan-2-ylpiperazin-1-yl)ethyl]pentan-2-amine
CID 62773872
[1-[2-(pentan-2-ylamino)ethyl]piperidin-4-yl]methanol
CID 115718460
N-[2-(3-methylpyrrolidin-1-yl)ethyl]pentan-2-amine
CID 62561816
N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]heptan-2-amine
CID 62560602
N-[2-(azepan-1-yl)ethyl]heptan-2-amine
CID 61241150
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethyl]pentan-2-amine
CID 104961127
N-[2-(7,7-dimethyl-1,4-thiazepan-4-yl)ethyl]pentan-2-amine
CID 107459657
N,N-dimethyl-1-[2-(pentan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 63167950
N-[2-(3-methoxypyrrolidin-1-yl)ethyl]pentan-2-amine
CID 103540061
N-[2-[3-(methoxymethyl)pyrrolidin-1-yl]ethyl]pentan-2-amine
CID 64582200
N-(2-pyrrolidin-1-ylethyl)butan-2-amine
CID 43181621
4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]pentan-2-amine
CID 60923926

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine?
The IUPAC name of N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine (CID 62776170) is N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine.
What is the SMILES notation for N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine?
The canonical SMILES for N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine is CCCC(C)NCCN1CCN(CC(C)C)CC1.
What is the InChIKey of N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine?
The InChIKey is BJDDWSLCICBJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-5-6-15(4)16-7-8-17-9-11-18(12-10-17)13-14(2)3/h14-16H,5-13H2,1-4H3.
What are the key properties of N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine?
N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine has a molecular weight of 255.45 g/mol, XLogP of 2.04, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]pentan-2-amine is sourced from PubChem (CID 62776170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).