N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine

C13H29N3 — CID 62432463

IUPACN,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine
SMILESCNCCCC(C)N1CCC(N(C)C)CC1
InChIInChI=1S/C13H29N3/c1-12(6-5-9-14-2)16-10-7-13(8-11-16)15(3)4/h12-14H,5-11H2,1-4H3
InChIKeyLIFBRFYPRDAHFY-UHFFFAOYSA-N
MW227.40 g/mol
LogP1.40
Rot. Bonds6

About N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine

N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine (PubChem CID 62432463) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine
PubChem CID62432463
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC NameN,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine
SMILESCNCCCC(C)N1CCC(N(C)C)CC1
InChIInChI=1S/C13H29N3/c1-12(6-5-9-14-2)16-10-7-13(8-11-16)15(3)4/h12-14H,5-11H2,1-4H3
InChIKeyLIFBRFYPRDAHFY-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 51.40
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

4-[4-[(dimethylamino)methyl]piperidin-1-yl]-N-methylpentan-1-amine
CID 62431308
N,N-dimethyl-1-[5-(propan-2-ylamino)pentan-2-yl]pyrrolidin-3-amine
CID 55158377
N-methyl-4-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 62431627
4-(4-ethoxypiperidin-1-yl)-N-methylpentan-1-amine
CID 62427995
N,N-dimethyl-1-[4-(2-methylpropylamino)butan-2-yl]piperidin-4-amine
CID 62432465
1-(4-aminobutan-2-yl)-N,N-dimethylpiperidin-4-amine
CID 60915047
1-butan-2-yl-N,N-dimethylpiperidin-4-amine
CID 90697678
N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine
CID 62438267
N,N-dimethyl-1-[1-(propan-2-ylamino)propan-2-yl]piperidin-4-amine
CID 62433161
4-(3-methoxypiperidin-1-yl)-N-methylpentan-1-amine
CID 102968095
N-ethyl-4-thiomorpholin-4-ylpentan-1-amine
CID 62417328
N-(2-methylpropyl)-4-thiomorpholin-4-ylpentan-1-amine
CID 62417518

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine (CID 62432463) is N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine is CNCCCC(C)N1CCC(N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine?
The InChIKey is LIFBRFYPRDAHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-12(6-5-9-14-2)16-10-7-13(8-11-16)15(3)4/h12-14H,5-11H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine?
N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine has a molecular weight of 227.40 g/mol, XLogP of 1.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-(methylamino)pentan-2-yl]piperidin-4-amine is sourced from PubChem (CID 62432463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).