N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine

C16H29N3O2 — CID 62287084

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
SMILESCOCCN(c1ccnc(CNC(C)C)c1)C(C)COC
InChIInChI=1S/C16H29N3O2/c1-13(2)18-11-15-10-16(6-7-17-15)19(8-9-20-4)14(3)12-21-5/h6-7,10,13-14,18H,8-9,11-12H2,1-5H3
InChIKeyIHBWWOUWPZMDON-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.07
Rot. Bonds10

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine (PubChem CID 62287084) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
PubChem CID62287084
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
SMILESCOCCN(c1ccnc(CNC(C)C)c1)C(C)COC
InChIInChI=1S/C16H29N3O2/c1-13(2)18-11-15-10-16(6-7-17-15)19(8-9-20-4)14(3)12-21-5/h6-7,10,13-14,18H,8-9,11-12H2,1-5H3
InChIKeyIHBWWOUWPZMDON-UHFFFAOYSA-N
XLogP2.07
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-(methylaminomethyl)pyridin-4-amine
CID 62289768
2-[(tert-butylamino)methyl]-N-(2-methoxyethyl)-N-propan-2-ylpyridin-4-amine
CID 82952467
4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-2-carbonitrile
CID 55156482
N-(4-fluorophenyl)-N-methyl-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62293187
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-4-(methylaminomethyl)pyridin-2-amine
CID 62289399
N-(2-methoxyethyl)-N-propan-2-yl-6-[(propan-2-ylamino)methyl]pyridazin-3-amine
CID 82952712
N-[[4-[2-(2-methoxyethoxy)ethoxy]-2-pyridinyl]methyl]propan-2-amine
CID 104566433
4-(chloromethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridin-2-amine
CID 55005343
2-(aminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 62285332
N-ethyl-N-(2-methylprop-2-enyl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62279471
5-N-(2-methoxyethyl)-5-N-(1-methoxypropan-2-yl)-3-N-methylpyridine-3,5-diamine
CID 104533784
N-[[4-(3-methylbutoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62292139

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine (CID 62287084) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine is COCCN(c1ccnc(CNC(C)C)c1)C(C)COC.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine?
The InChIKey is IHBWWOUWPZMDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-13(2)18-11-15-10-16(6-7-17-15)19(8-9-20-4)14(3)12-21-5/h6-7,10,13-14,18H,8-9,11-12H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine has a molecular weight of 295.43 g/mol, XLogP of 2.07, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[(propan-2-ylamino)methyl]pyridin-4-amine is sourced from PubChem (CID 62287084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).