N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine

C14H30N4 — CID 105414842

IUPACN,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine
SMILESCN(CCN1CCNCC1)CC1(N(C)C)CCC1
InChIInChI=1S/C14H30N4/c1-16(2)14(5-4-6-14)13-17(3)11-12-18-9-7-15-8-10-18/h15H,4-13H2,1-3H3
InChIKeyKDSYMKFIROOWKP-UHFFFAOYSA-N
MW254.42 g/mol
LogP0.31
Rot. Bonds6

About N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine

N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine (PubChem CID 105414842) has the molecular formula C14H30N4 and a molecular weight of 254.42 g/mol. Its IUPAC name is N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine
PubChem CID105414842
Molecular FormulaC14H30N4
Molecular Weight254.42 g/mol
Exact Mass254.25
IUPAC NameN,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine
SMILESCN(CCN1CCNCC1)CC1(N(C)C)CCC1
InChIInChI=1S/C14H30N4/c1-16(2)14(5-4-6-14)13-17(3)11-12-18-9-7-15-8-10-18/h15H,4-13H2,1-3H3
InChIKeyKDSYMKFIROOWKP-UHFFFAOYSA-N
XLogP0.31
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-(1,4-diazepan-1-yl)ethyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105421291
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylethanamine
CID 63236887
N-(cyclobutylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 62860620
N-methyl-N-(2-piperazin-1-ylethyl)prop-2-en-1-amine
CID 63265346
N,N,N'-trimethyl-N'-(2-piperazin-1-ylethyl)propane-1,3-diamine
CID 63695224
2-(1,4-diazepan-1-yl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethanamine
CID 63274337
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylpiperazine-1-sulfonamide
CID 105415384
N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine
CID 102657082
1-[[3-bromopropyl(methyl)amino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105416269
N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine
CID 63265554
N,N'-dimethyl-N'-[2-[methyl(2-piperazin-1-ylethyl)amino]ethyl]ethane-1,2-diamine
CID 126510399
N-(cyclopentylmethyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
CID 115230585

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine?
The IUPAC name of N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine (CID 105414842) is N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine is CN(CCN1CCNCC1)CC1(N(C)C)CCC1.
What is the InChIKey of N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine?
The InChIKey is KDSYMKFIROOWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4/c1-16(2)14(5-4-6-14)13-17(3)11-12-18-9-7-15-8-10-18/h15H,4-13H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine?
N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 0.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine is sourced from PubChem (CID 105414842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).