N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine

C15H31N3O — CID 55157989

IUPACN,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine
SMILESCC(C)NCC1CCC(CN2CCC(N(C)C)C2)O1
InChIInChI=1S/C15H31N3O/c1-12(2)16-9-14-5-6-15(19-14)11-18-8-7-13(10-18)17(3)4/h12-16H,5-11H2,1-4H3
InChIKeyTZZLZFGSAUDKDN-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.17
Rot. Bonds6

About N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine

N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine (PubChem CID 55157989) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine
PubChem CID55157989
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine
SMILESCC(C)NCC1CCC(CN2CCC(N(C)C)C2)O1
InChIInChI=1S/C15H31N3O/c1-12(2)16-9-14-5-6-15(19-14)11-18-8-7-13(10-18)17(3)4/h12-16H,5-11H2,1-4H3
InChIKeyTZZLZFGSAUDKDN-UHFFFAOYSA-N
XLogP1.17
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methyl]propan-2-amine
CID 62437899
N-[[5-[(4-tert-butylpiperazin-1-yl)methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62463360
1-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N,N-dimethylpiperidin-4-amine
CID 62433914
N-[[5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)oxolan-2-yl]methyl]propan-2-amine
CID 62424996
N,N-diethyl-1-[[5-(methylaminomethyl)oxolan-2-yl]methyl]pyrrolidin-3-amine
CID 63166921
N-[[5-[[ethyl(methyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62419141
N,N-dimethyl-1-[2-(3-methylbutan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 63167315
N-[[1-(oxolan-2-ylmethyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62513685
N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
CID 62437708
1-[2-(ethylamino)propyl]-N,N-dimethylpyrrolidin-3-amine
CID 63164255
N-(2-methylpropyl)-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62428846
N,N-dimethyl-1-[2-(pentan-2-ylamino)ethyl]pyrrolidin-3-amine
CID 63167950

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine?
The IUPAC name of N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine (CID 55157989) is N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine is CC(C)NCC1CCC(CN2CCC(N(C)C)C2)O1.
What is the InChIKey of N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine?
The InChIKey is TZZLZFGSAUDKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(2)16-9-14-5-6-15(19-14)11-18-8-7-13(10-18)17(3)4/h12-16H,5-11H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine?
N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine has a molecular weight of 269.43 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]pyrrolidin-3-amine is sourced from PubChem (CID 55157989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).