N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine

C15H26N2 — CID 69133022

IUPACN,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine
SMILESCC1C(CN(C)C)=CC=C1CN1CCCCC1
InChIInChI=1S/C15H26N2/c1-13-14(11-16(2)3)7-8-15(13)12-17-9-5-4-6-10-17/h7-8,13H,4-6,9-12H2,1-3H3
InChIKeyWNLDQIUBGSTSLW-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.54
Rot. Bonds4

About N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine

N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine (PubChem CID 69133022) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine
PubChem CID69133022
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine
SMILESCC1C(CN(C)C)=CC=C1CN1CCCCC1
InChIInChI=1S/C15H26N2/c1-13-14(11-16(2)3)7-8-15(13)12-17-9-5-4-6-10-17/h7-8,13H,4-6,9-12H2,1-3H3
InChIKeyWNLDQIUBGSTSLW-UHFFFAOYSA-N
XLogP2.54
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethylpiperidine
CID 13007
1-[(4-methylphenyl)methyl]azepane
CID 3951815
bicyclo[2.2.0]hexa-1,3,5-triene;1-ethylpiperidine
CID 70007313
1-[[4-[(dimethylamino)methyl]thiophen-2-yl]methyl]-N,N-dimethylazepan-4-amine
CID 74251551
1-[(2,6-difluoro-4-methylcyclohexa-1,5-dien-1-yl)methyl]piperidine
CID 123953860
1-[(3,4,5-trimethylphenyl)methyl]piperidine
CID 91162015
ethane;1-[(4-methylphenyl)methyl]piperidine
CID 143603243
1-ethylpiperidine;methane
CID 162133943
ethane;1-ethylpiperidine
CID 90845344
1-benzylazepane
CID 10954328
N-cyclopentyl-N-methyl-4-(piperidin-1-ylmethyl)benzamide
CID 46772901
1-[(4-bromo-1-methylpyrazol-3-yl)methyl]piperidine
CID 131212413

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine (CID 69133022) is N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine is CC1C(CN(C)C)=CC=C1CN1CCCCC1.
What is the InChIKey of N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine?
The InChIKey is WNLDQIUBGSTSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-13-14(11-16(2)3)7-8-15(13)12-17-9-5-4-6-10-17/h7-8,13H,4-6,9-12H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine?
N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine has a molecular weight of 234.39 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-methyl-4-(piperidin-1-ylmethyl)cyclopenta-1,3-dien-1-yl]methanamine is sourced from PubChem (CID 69133022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).