2-(4-propylpiperidin-1-yl)nonan-1-amine

C17H36N2 — CID 63465247

IUPAC2-(4-propylpiperidin-1-yl)nonan-1-amine
SMILESCCCCCCCC(CN)N1CCC(CCC)CC1
InChIInChI=1S/C17H36N2/c1-3-5-6-7-8-10-17(15-18)19-13-11-16(9-4-2)12-14-19/h16-17H,3-15,18H2,1-2H3
InChIKeyYGSMQUNQBVTQDK-UHFFFAOYSA-N
MW268.49 g/mol
LogP4.19
Rot. Bonds10

About 2-(4-propylpiperidin-1-yl)nonan-1-amine

2-(4-propylpiperidin-1-yl)nonan-1-amine (PubChem CID 63465247) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 2-(4-propylpiperidin-1-yl)nonan-1-amine.

Molecular Properties

Compound Name2-(4-propylpiperidin-1-yl)nonan-1-amine
PubChem CID63465247
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name2-(4-propylpiperidin-1-yl)nonan-1-amine
SMILESCCCCCCCC(CN)N1CCC(CCC)CC1
InChIInChI=1S/C17H36N2/c1-3-5-6-7-8-10-17(15-18)19-13-11-16(9-4-2)12-14-19/h16-17H,3-15,18H2,1-2H3
InChIKeyYGSMQUNQBVTQDK-UHFFFAOYSA-N
XLogP4.19
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[4-(cyclopropylmethyl)piperazin-1-yl]octan-1-amine
CID 61441064
1-pentadecan-8-ylpiperidin-4-amine
CID 134177605
2-(azocan-1-yl)nonan-1-amine
CID 43130470
2-[4-(methoxymethyl)piperidin-1-yl]hexan-1-amine
CID 63971703
2-(4-cyclopentylpiperazin-1-yl)octan-1-amine
CID 62369576
2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)nonan-1-amine
CID 43620229
2-(4-ethoxypiperidin-1-yl)hexan-1-amine
CID 61351754
2-(3,4-dimethylpyrrolidin-1-yl)octan-1-amine
CID 79188205
2-(4-butan-2-ylpiperazin-1-yl)octan-1-amine
CID 62772459
2-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-amine
CID 64568314
2-thiomorpholin-4-ylheptan-1-amine
CID 43130462
2-(4,4-diethylpiperidin-1-yl)octan-1-amine
CID 55192466

Frequently Asked Questions

What is the IUPAC name of 2-(4-propylpiperidin-1-yl)nonan-1-amine?
The IUPAC name of 2-(4-propylpiperidin-1-yl)nonan-1-amine (CID 63465247) is 2-(4-propylpiperidin-1-yl)nonan-1-amine.
What is the SMILES notation for 2-(4-propylpiperidin-1-yl)nonan-1-amine?
The canonical SMILES for 2-(4-propylpiperidin-1-yl)nonan-1-amine is CCCCCCCC(CN)N1CCC(CCC)CC1.
What is the InChIKey of 2-(4-propylpiperidin-1-yl)nonan-1-amine?
The InChIKey is YGSMQUNQBVTQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-3-5-6-7-8-10-17(15-18)19-13-11-16(9-4-2)12-14-19/h16-17H,3-15,18H2,1-2H3.
What are the key properties of 2-(4-propylpiperidin-1-yl)nonan-1-amine?
2-(4-propylpiperidin-1-yl)nonan-1-amine has a molecular weight of 268.49 g/mol, XLogP of 4.19, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propylpiperidin-1-yl)nonan-1-amine is sourced from PubChem (CID 63465247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).