1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine

C14H29N3O — CID 62888537

IUPAC1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine
SMILESCNCC1CCC(CN2CCCC2CN(C)C)O1
InChIInChI=1S/C14H29N3O/c1-15-9-13-6-7-14(18-13)11-17-8-4-5-12(17)10-16(2)3/h12-15H,4-11H2,1-3H3
InChIKeyDLYWXBLQYHBNOY-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.78
Rot. Bonds6

About 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine

1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine (PubChem CID 62888537) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine
PubChem CID62888537
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine
SMILESCNCC1CCC(CN2CCCC2CN(C)C)O1
InChIInChI=1S/C14H29N3O/c1-15-9-13-6-7-14(18-13)11-17-8-4-5-12(17)10-16(2)3/h12-15H,4-11H2,1-3H3
InChIKeyDLYWXBLQYHBNOY-UHFFFAOYSA-N
XLogP0.78
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-[(dimethylamino)methyl]oxolan-2-yl]-N-methylmethanamine
CID 62419753
N-methyl-1-[5-(pyrrolidin-1-ylmethyl)oxolan-2-yl]methanamine
CID 62437708
N-[[5-[(2-ethylpyrrolidin-1-yl)methyl]oxolan-2-yl]methyl]propan-1-amine
CID 62439517
2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62887699
4-[2-[(dimethylamino)methyl]piperidin-1-yl]-N-methylbutan-1-amine
CID 19846007
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-methylpropan-2-amine
CID 62886469
N-[2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]ethyl]cyclopropanamine
CID 62886265
5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79855490
N-methyl-1-[5-[(2,3,5-trimethylpiperidin-1-yl)methyl]oxolan-2-yl]methanamine
CID 114597089
N,N-dimethyl-1-[1-[[1-(methylaminomethyl)cyclopentyl]methyl]pyrrolidin-2-yl]methanamine
CID 62888681
3-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]cyclopentan-1-amine
CID 66010510
4-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-methylbutan-2-amine
CID 62886637

Frequently Asked Questions

What is the IUPAC name of 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine (CID 62888537) is 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine is CNCC1CCC(CN2CCCC2CN(C)C)O1.
What is the InChIKey of 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine?
The InChIKey is DLYWXBLQYHBNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-15-9-13-6-7-14(18-13)11-17-8-4-5-12(17)10-16(2)3/h12-15H,4-11H2,1-3H3.
What are the key properties of 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine?
1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine has a molecular weight of 255.41 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]oxolan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 62888537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).