N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine

C15H29N3 — CID 80997684

IUPACN-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)C2CCC2CNC2CC2)CC1
InChIInChI=1S/C15H29N3/c1-17-9-7-14(8-10-17)18(2)15-6-3-12(15)11-16-13-4-5-13/h12-16H,3-11H2,1-2H3
InChIKeyRZVKBSRARNHIAN-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.54
Rot. Bonds5

About N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine

N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine (PubChem CID 80997684) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine
PubChem CID80997684
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC NameN-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)C2CCC2CNC2CC2)CC1
InChIInChI=1S/C15H29N3/c1-17-9-7-14(8-10-17)18(2)15-6-3-12(15)11-16-13-4-5-13/h12-16H,3-11H2,1-2H3
InChIKeyRZVKBSRARNHIAN-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-3-amine
CID 80998463
N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N-methylcycloheptanamine
CID 80999025
N-[2-(ethylaminomethyl)cyclobutyl]-N,1-dimethylpiperidin-4-amine
CID 80998347
N-[2-[(tert-butylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine
CID 80998205
N-butan-2-yl-2-[(cyclopropylamino)methyl]-N-methylcyclobutan-1-amine
CID 80999784
N-[2-(aminomethyl)cycloheptyl]-N,1-dimethylpiperidin-4-amine
CID 43329366
1-[[[2-[(cyclopropylamino)methyl]cyclobutyl]-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105418059
molecular hydrogen;trans-(1S,2S)-2-N-methyl-2-N-(1-methylpiperidin-4-yl)cyclohexane-1,2-diamine
CID 142330056
N-methyl-N-[2-[(propan-2-ylamino)methyl]cyclobutyl]cyclopentanamine
CID 80999304
3-N-methyl-3-N-(1-methylpiperidin-4-yl)-1-N-propylcyclopentane-1,3-diamine
CID 79642701
1-N-cyclopropyl-2-N-methyl-2-N-(1-methylpiperidin-4-yl)propane-1,2-diamine
CID 62425020
2-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylcyclobutan-1-amine
CID 80998217

Frequently Asked Questions

What is the IUPAC name of N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine?
The IUPAC name of N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine (CID 80997684) is N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine.
What is the SMILES notation for N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine?
The canonical SMILES for N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine is CN1CCC(N(C)C2CCC2CNC2CC2)CC1.
What is the InChIKey of N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine?
The InChIKey is RZVKBSRARNHIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-17-9-7-14(8-10-17)18(2)15-6-3-12(15)11-16-13-4-5-13/h12-16H,3-11H2,1-2H3.
What are the key properties of N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine?
N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine has a molecular weight of 251.42 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(cyclopropylamino)methyl]cyclobutyl]-N,1-dimethylpiperidin-4-amine is sourced from PubChem (CID 80997684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).