N-[2-(oxolan-2-yl)ethyl]nonan-1-amine

C15H31NO — CID 61039120

IUPACN-[2-(oxolan-2-yl)ethyl]nonan-1-amine
SMILESCCCCCCCCCNCCC1CCCO1
InChIInChI=1S/C15H31NO/c1-2-3-4-5-6-7-8-12-16-13-11-15-10-9-14-17-15/h15-16H,2-14H2,1H3
InChIKeyYUZDOJKQFRFWMY-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.90
Rot. Bonds11

About N-[2-(oxolan-2-yl)ethyl]nonan-1-amine

N-[2-(oxolan-2-yl)ethyl]nonan-1-amine (PubChem CID 61039120) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is N-[2-(oxolan-2-yl)ethyl]nonan-1-amine.

Molecular Properties

Compound NameN-[2-(oxolan-2-yl)ethyl]nonan-1-amine
PubChem CID61039120
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC NameN-[2-(oxolan-2-yl)ethyl]nonan-1-amine
SMILESCCCCCCCCCNCCC1CCCO1
InChIInChI=1S/C15H31NO/c1-2-3-4-5-6-7-8-12-16-13-11-15-10-9-14-17-15/h15-16H,2-14H2,1H3
InChIKeyYUZDOJKQFRFWMY-UHFFFAOYSA-N
XLogP3.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.90
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-tetradecyloxolane
CID 10683364
2-(oxolan-2-yl)-N-(2-propoxyethyl)ethanamine
CID 106451738
N',N'-dimethyl-N-[2-(oxolan-2-yl)ethyl]propane-1,3-diamine
CID 65164090
N-butyl-N'-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 54806845
N'-methyl-N'-(oxolan-2-ylmethyl)-N-pentylethane-1,2-diamine
CID 62555308
6-chloro-N-[3-(oxolan-2-yl)propyl]hexan-1-amine
CID 107845985
N-[2-(4-methylcyclohexyl)ethyl]-3-(oxolan-2-yl)propan-1-amine
CID 65164076
N-[2-(oxolan-2-yl)ethyl]undecan-6-amine
CID 63452863
5-[2-(oxolan-2-yl)ethylamino]pentanamide
CID 106237094
2-hexyloxolane;oxolane
CID 173130151
N-ethyl-2-(oxan-2-yl)ethanamine
CID 62549165
2-(hexadecylamino)-N-(oxolan-2-ylmethyl)acetamide
CID 54808872

Frequently Asked Questions

What is the IUPAC name of N-[2-(oxolan-2-yl)ethyl]nonan-1-amine?
The IUPAC name of N-[2-(oxolan-2-yl)ethyl]nonan-1-amine (CID 61039120) is N-[2-(oxolan-2-yl)ethyl]nonan-1-amine.
What is the SMILES notation for N-[2-(oxolan-2-yl)ethyl]nonan-1-amine?
The canonical SMILES for N-[2-(oxolan-2-yl)ethyl]nonan-1-amine is CCCCCCCCCNCCC1CCCO1.
What is the InChIKey of N-[2-(oxolan-2-yl)ethyl]nonan-1-amine?
The InChIKey is YUZDOJKQFRFWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-2-3-4-5-6-7-8-12-16-13-11-15-10-9-14-17-15/h15-16H,2-14H2,1H3.
What are the key properties of N-[2-(oxolan-2-yl)ethyl]nonan-1-amine?
N-[2-(oxolan-2-yl)ethyl]nonan-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.90, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(oxolan-2-yl)ethyl]nonan-1-amine is sourced from PubChem (CID 61039120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).