N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine

C11H24N2 — CID 62438267

IUPACN-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine
SMILESCNCCC(C)N1CCC(C)CC1
InChIInChI=1S/C11H24N2/c1-10-5-8-13(9-6-10)11(2)4-7-12-3/h10-12H,4-9H2,1-3H3
InChIKeyMDMOLOBDOFSGFY-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.72
Rot. Bonds4

About N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine

N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine (PubChem CID 62438267) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine
PubChem CID62438267
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine
SMILESCNCCC(C)N1CCC(C)CC1
InChIInChI=1S/C11H24N2/c1-10-5-8-13(9-6-10)11(2)4-7-12-3/h10-12H,4-9H2,1-3H3
InChIKeyMDMOLOBDOFSGFY-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine
CID 103539768
N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine
CID 62432463
2-(4-methylpiperidin-1-yl)propane-1-thiol
CID 174269339
N-[4-(4-methylazepan-1-yl)pentyl]cyclopropanamine
CID 55249022
4-(4-methylazepan-1-yl)-N-propylpentan-1-amine
CID 55248637
4-[4-[(dimethylamino)methyl]piperidin-1-yl]-N-methylpentan-1-amine
CID 62431308
4-(4-ethoxypiperidin-1-yl)-N-methylpentan-1-amine
CID 62427995
2-(methylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]acetamide
CID 120704077
3-(3-ethyl-4-methylpiperazin-1-yl)-N-methylbutan-1-amine
CID 63620150
N-methyl-3-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)butan-1-amine
CID 106316730
N-methyl-4-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 62431627
3-(3-methylpyrrolidin-1-yl)butan-1-amine
CID 61224022

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine?
The IUPAC name of N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine (CID 62438267) is N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine.
What is the SMILES notation for N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine?
The canonical SMILES for N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine is CNCCC(C)N1CCC(C)CC1.
What is the InChIKey of N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine?
The InChIKey is MDMOLOBDOFSGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10-5-8-13(9-6-10)11(2)4-7-12-3/h10-12H,4-9H2,1-3H3.
What are the key properties of N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine?
N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine is sourced from PubChem (CID 62438267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).